data_2n22_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2n22 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.539 ' CD2' HG22 ' A' ' 103' ' ' THR . 76.5 m80 . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 112.217 0.451 . . . . 1.08 112.217 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.1 p -147.77 161.59 40.94 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 119.807 -0.757 . . . . 1.78 112.212 -177.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.436 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -177.82 -166.21 34.01 Favored Glycine 0 N--CA 1.44 -1.063 0 CA-C-N 114.803 -1.089 . . . . 0.16 110.413 -178.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.16 132.98 44.08 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 117.432 0.616 . . . . 1.04 110.241 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.454 ' HB2' ' HB3' ' A' ' 89' ' ' PHE . . . -144.58 145.51 31.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.952 0.406 . . . . 1.02 111.578 -176.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.425 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 84.4 mt -110.84 111.05 34.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.26 -0.427 . . . . 1.17 110.246 178.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -112.51 137.33 50.89 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.714 -0.847 . . . . 0.43 108.714 -178.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 57.1 23.28 8.31 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.966 0.412 . . . . 0.8 110.479 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt 68.6 6.48 5.48 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.237 -0.892 . . . . 2.57 112.741 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.5 p -94.04 122.16 45.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 108.025 -1.102 . . . . 1.1 108.025 166.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.9 p -76.21 142.49 41.47 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.896 0.379 . . . . 1.5 111.293 -173.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.446 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -160.72 -157.72 8.88 Favored Glycine 0 N--CA 1.437 -1.282 0 C-N-CA 120.325 -0.941 . . . . 0.12 113.083 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 24.6 mm -126.66 135.58 63.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.095 -0.706 . . . . 1.02 109.095 -178.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.421 HD11 HD13 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.27 135.84 40.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.972 -0.381 . . . . 1.05 109.972 -176.428 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.98 126.71 25.5 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.846 0.355 . . . . 1.04 111.642 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.531 HD12 ' HA ' ' A' ' 3' ' ' HIS . 71.0 mt -85.24 134.38 27.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.023 0.439 . . . . 1.04 109.988 177.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -105.49 102.22 11.7 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.806 -0.633 . . . . 1.98 110.847 -175.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.426 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 23.9 mt-10 -116.66 169.68 9.17 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.166 -0.679 . . . . 1.2 109.166 174.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.426 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 26.6 t0 77.5 -1.32 2.71 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.474 1.131 . . . . 0.58 109.513 -175.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.605 HG21 ' O ' ' A' ' 23' ' ' SER . 30.0 m -104.56 -174.67 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 113.762 -1.563 . . . . 1.05 109.766 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.605 ' O ' HG21 ' A' ' 22' ' ' VAL . 43.1 m -73.59 169.46 18.34 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 105.46 -2.052 . . . . 1.77 105.46 174.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo -41.77 128.62 3.83 Favored 'Trans proline' 0 C--N 1.359 1.08 0 CA-C-N 121.624 1.616 . . . . 0.19 112.095 -143.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.429 ' HB1' ' CG2' ' A' ' 107' ' ' ILE . . . -55.77 143.1 32.17 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 114.194 -1.367 . . . . 1.03 112.198 -161.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.99 167.83 14.77 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 114.715 -1.129 . . . . 0.32 111.92 -170.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.492 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -118.09 107.86 14.51 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.627 -1.249 . . . . 1.02 107.627 175.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 m -102.97 106.5 17.04 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.772 0.32 . . . . 1.02 110.875 -175.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.4 t90 -87.16 131.8 34.06 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.888 -0.782 . . . . 0.17 108.888 171.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.44 ' HG2' HG21 ' A' ' 37' ' ' VAL . 60.0 mtt180 -126.36 157.88 37.31 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.918 -0.771 . . . . 2.24 108.918 174.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -67.12 172.79 4.26 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.184 -0.673 . . . . 0.63 109.184 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.446 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.2 p -57.59 -32.36 67.09 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.323 -0.551 . . . . 0.96 111.242 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -93.58 -32.18 14.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.581 0.705 . . . . 2.12 109.546 172.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.59 17.39 26.36 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 114.921 -1.036 . . . . 0.23 112.693 177.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.82 -29.37 66.63 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.269 0.557 . . . . 1.73 109.743 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -103.1 141.2 36.24 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.536 -0.912 . . . . 1.91 108.536 173.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.44 HG21 ' HG2' ' A' ' 30' ' ' ARG . 12.0 p -149.98 140.39 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.719 -0.392 . . . . 1.04 111.489 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -144.47 125.45 14.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.435 . . . . 0.54 109.969 177.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.45 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 26.4 m -111.21 133.48 53.52 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 111.876 0.324 . . . . 1.04 111.876 -175.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.08 127.73 58.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.297 -1.001 . . . . 1.04 108.297 168.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.2 t -92.25 119.19 39.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 O-C-N 121.11 -0.994 . . . . 1.02 108.863 173.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -68.28 -16.58 64.01 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.433 0.531 . . . . 1.01 112.433 -170.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.55 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 92.9 p -70.03 -14.8 62.85 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.32 -0.622 . . . . 1.07 109.32 175.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.3 p -112.76 11.13 19.33 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.103 -0.953 . . . . 1.03 110.188 -178.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.536 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 26.7 mm -108.13 139.84 28.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.5 -0.555 . . . . 1.01 109.5 178.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -102.13 -43.83 5.62 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.194 -0.457 . . . . 0.52 110.604 -177.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.1 mtmm -139.58 171.75 13.79 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.069 0.461 . . . . 1.95 110.867 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.477 ' CD2' ' HB3' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -150.31 151.95 33.71 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.383 -0.969 . . . . 1.39 108.383 178.482 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.457 ' HG3' HD13 ' A' ' 63' ' ' ILE . 2.3 mt-30 -139.02 145.98 40.3 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 109.777 -0.453 . . . . 2.02 109.777 -177.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.494 ' HB1' ' HD3' ' A' ' 101' ' ' LYS . . . -137.74 132.81 33.32 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 122.09 -0.381 . . . . 1.05 110.24 174.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.474 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 64.1 p -60.18 118.62 34.85 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.74 -0.664 . . . . 1.05 110.803 -176.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.466 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 24.6 Cg_exo -54.61 159.75 8.25 Favored 'Trans proline' 0 N--CA 1.464 -0.214 0 C-N-CA 122.776 2.318 . . . . 0.44 112.191 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.82 -21.27 66.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.011 -0.54 . . . . 1.21 111.007 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.2 p -83.42 -16.72 44.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.964 -0.562 . . . . 1.94 111.05 176.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.466 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 56.0 m -77.3 134.77 38.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.919 -0.582 . . . . 1.13 111.323 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -56.53 -32.84 65.49 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 114.999 -1.0 . . . . 1.77 110.11 172.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.43 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 35.7 mmtm -75.62 151.67 37.77 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.367 -1.288 . . . . 2.18 111.471 -176.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.474 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 5.3 mtp -131.31 98.76 4.63 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.257 -0.883 . . . . 1.11 109.454 169.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.469 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.3 OUTLIER -158.02 158.06 34.13 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.485 -0.78 . . . . 1.05 111.38 -171.613 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.436 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.4 tt -133.31 119.6 19.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.873 -1.058 . . . . 1.05 108.2 176.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.566 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.8 mtp180 -103.13 145.68 29.55 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.273 0.559 . . . . 3.5 111.476 -178.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.509 HD22 HD11 ' A' ' 104' ' ' LEU . 1.3 mm? -127.76 107.37 9.83 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.919 -1.037 . . . . 1.03 108.992 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.523 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.3 mp -88.49 103.8 14.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.745 0.307 . . . . 1.11 110.826 -171.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -67.01 144.08 44.34 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.107 -0.497 . . . . 0.54 112.164 178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.536 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 84.6 mttt . . . . . 0 C--N 1.319 -0.739 0 N-CA-C 112.488 0.551 . . . . 1.08 112.488 -176.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.847 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 10.4 t70 . . . . . 0 N--CA 1.446 -0.666 0 N-CA-C 109.107 -0.701 . . . . 3.23 109.107 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -87.52 -2.62 58.74 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.021 0.378 . . . . 2.39 112.021 -175.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.2 p -68.76 -18.24 64.18 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.573 0.701 . . . . 3.2 109.612 175.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.847 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 2.7 ptpp? -84.16 35.3 0.53 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.196 -0.911 . . . . 2.95 110.943 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -45.16 115.07 0.83 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.413 0.625 . . . . 3.72 110.139 -176.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.544 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 78.1 ttt180 -90.48 159.25 16.62 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.884 -1.053 . . . . 4.12 108.664 -171.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mtpt -124.74 131.34 53.46 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 119.824 -0.75 . . . . 4.59 110.637 174.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.9 167.5 4.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.765 -1.107 . . . . 4.41 110.692 177.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -55.15 -32.86 62.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.756 0.312 . . . . 5.69 111.31 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 12.9 mm-40 -86.98 11.98 12.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.962 0.411 . . . . 5.38 111.537 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.17 32.0 65.95 Favored Glycine 0 N--CA 1.452 -0.287 0 CA-C-N 115.972 -0.558 . . . . 4.47 113.051 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.503 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 60.9 m-80 -89.52 130.61 35.82 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.23 -0.656 . . . . 4.72 109.23 174.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -64.51 104.2 0.76 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.569 -0.53 . . . . 4.28 109.569 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 7.4 m -120.63 97.91 5.56 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 122.022 0.915 . . . . 3.51 109.518 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.42 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 p -90.42 126.71 55.55 Favored Pre-proline 0 C--N 1.31 -1.13 0 CA-C-N 115.339 -0.846 . . . . 2.87 110.195 -175.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.435 ' HG2' ' CD ' ' A' ' 70' ' ' LYS . 78.4 Cg_exo . . . . . 0 C--N 1.348 0.51 0 C-N-CA 122.993 2.462 . . . . 2.06 112.449 -176.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.557 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 82.0 m-70 . . . . . 0 N--CA 1.447 -0.598 0 N-CA-C 107.088 -1.449 . . . . 0.72 107.088 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.566 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 19.9 ttm -140.99 124.21 16.52 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 118.904 0.775 . . . . 1.07 111.067 176.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.454 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 6.4 m-85 -113.94 128.17 56.28 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.227 -0.897 . . . . 0.27 109.641 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.459 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.6 OUTLIER -80.4 152.27 28.94 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.925 -0.398 . . . . 1.68 109.925 177.732 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.436 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 19.9 m-85 -133.55 171.94 13.42 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.298 0.571 . . . . 0.32 111.835 -173.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -122.73 -8.03 8.48 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.035 -0.984 . . . . 2.7 110.894 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -146.01 128.31 15.81 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.213 0.53 . . . . 1.16 110.777 -176.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.419 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 8.6 mmm180 -63.24 -38.58 91.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.105 -0.952 . . . . 3.7 112.183 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 86.8 m -60.98 -36.3 79.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.816 0.341 . . . . 1.13 110.739 -178.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.605 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.0 t -67.41 -55.17 18.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.367 -0.379 . . . . 1.06 110.471 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.432 ' HA ' HD13 ' A' ' 60' ' ' LEU . 12.3 ptp -60.39 -36.54 78.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 1.02 111.128 -176.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.434 ' O ' ' HB2' ' A' ' 102' ' ' MET . 23.2 t70 -66.96 -42.96 84.29 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.544 -0.463 . . . . 0.34 110.132 177.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.442 ' O ' ' HB3' ' A' ' 102' ' ' MET . 1.5 t-20 -67.2 -44.95 78.33 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.437 0.46 . . . . 1.58 111.185 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.605 HG12 ' O ' ' A' ' 96' ' ' VAL . 33.6 mm -61.44 -56.36 18.32 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 109.412 -0.588 . . . . 1.01 109.412 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.494 ' HD3' ' HB1' ' A' ' 50' ' ' ALA . 18.9 ttpp -52.72 -44.57 66.44 Favored 'General case' 0 C--O 1.216 -0.678 0 O-C-N 123.529 0.518 . . . . 1.47 110.028 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.507 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 40.1 ttp -51.34 -54.17 28.93 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.075 -0.966 . . . . 1.02 111.24 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.747 ' O ' HG13 ' A' ' 107' ' ' ILE . 99.0 m -62.94 -51.31 67.41 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.419 -0.355 . . . . 1.04 110.877 178.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 29.5 mt -46.68 -53.52 11.51 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.728 0.775 . . . . 1.04 110.514 175.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.434 ' CG ' HD12 ' A' ' 48' ' ' LEU . 23.0 mt-30 -54.84 -41.96 71.36 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.366 -1.288 . . . . 1.96 112.345 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 102' ' ' MET . 14.7 mm100 -64.19 -33.65 76.29 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.915 0.864 . . . . 3.11 109.841 178.078 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.747 HG13 ' O ' ' A' ' 103' ' ' THR . 14.9 mt -76.59 -46.16 31.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.25 -1.341 . . . . 1.03 111.426 -177.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.8 mt -62.31 -41.39 91.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.312 -0.404 . . . . 1.04 111.976 -176.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.1 t -57.79 -25.58 60.75 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.711 0.291 . . . . 1.67 111.028 -177.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 76.9 mtt180 -64.78 -39.8 94.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.368 0.604 . . . . 1.99 109.879 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.55 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 32.5 m-85 -93.84 -10.17 34.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.193 -179.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 112' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.605 0 N-CA-C 108.523 -0.917 . . . . 1.46 108.523 174.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 68.6 m80 . . . . . 0 N--CA 1.469 0.496 0 N-CA-C 112.881 0.696 . . . . 1.08 112.881 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 p -146.53 167.24 24.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.647 0.737 . . . . 1.78 112.962 -172.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.478 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 176.01 -165.97 36.86 Favored Glycine 0 N--CA 1.445 -0.761 0 CA-C-N 114.511 -1.222 . . . . 0.16 110.049 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.81 135.69 38.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 118.017 0.908 . . . . 1.04 110.461 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.54 146.71 32.51 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.014 0.435 . . . . 1.02 111.111 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.513 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 52.2 mt -110.38 111.06 34.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.911 -0.586 . . . . 1.17 110.054 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -112.57 132.32 55.18 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 108.598 -0.89 . . . . 0.43 108.598 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 58.51 25.2 12.76 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 120.962 0.411 . . . . 0.8 110.539 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.7 mtpt 68.98 4.12 4.36 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.551 -0.75 . . . . 2.57 112.901 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.41 ' O ' ' HZ2' ' A' ' 29' ' ' TRP . 1.2 p -92.37 115.25 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 107.697 -1.224 . . . . 1.1 107.697 166.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.0 m -71.92 145.75 48.28 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.057 -0.52 . . . . 1.5 110.82 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.73 -158.76 10.57 Favored Glycine 0 N--CA 1.433 -1.538 0 C-N-CA 119.914 -1.136 . . . . 0.12 113.196 -177.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.7 mm -126.18 132.03 70.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 109.336 -0.616 . . . . 1.02 109.336 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.403 HD12 HD12 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -100.49 134.93 38.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.721 -0.474 . . . . 1.05 109.721 -177.559 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.11 128.18 27.7 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.416 -0.356 . . . . 1.04 111.054 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.2 mt -85.1 138.07 19.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.387 0.613 . . . . 1.04 109.932 175.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -106.93 99.4 8.97 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 114.808 -1.087 . . . . 1.98 110.299 -176.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -113.97 169.71 8.8 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.317 -0.623 . . . . 1.2 109.317 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.2 t70 76.16 -2.1 2.81 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 122.107 0.956 . . . . 0.58 109.857 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 23' ' ' SER . 34.6 m -103.2 -173.59 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.156 -1.384 . . . . 1.05 109.742 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.618 ' O ' HG22 ' A' ' 22' ' ' VAL . 28.4 m -72.68 167.31 34.57 Favored Pre-proline 0 C--N 1.318 -0.79 0 N-CA-C 105.065 -2.198 . . . . 1.77 105.065 173.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -42.09 127.71 3.99 Favored 'Trans proline' 0 C--N 1.355 0.896 0 CA-C-N 121.279 1.492 . . . . 0.19 112.412 -140.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -50.53 138.57 17.34 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 113.942 -1.481 . . . . 1.03 112.399 -166.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -123.39 168.77 12.1 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 114.259 -1.337 . . . . 0.32 111.817 -170.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.489 ' HB3' HG23 ' A' ' 40' ' ' VAL . 3.1 tm? -117.15 106.5 13.4 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.324 -1.361 . . . . 1.02 107.324 172.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.3 m -102.52 106.22 16.89 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 120.887 0.375 . . . . 1.02 110.785 -176.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.41 ' HZ2' ' O ' ' A' ' 12' ' ' VAL . 81.5 t90 -85.24 132.14 34.32 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.781 -0.822 . . . . 0.17 108.781 172.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.439 ' HG2' HG22 ' A' ' 37' ' ' VAL . 57.1 mtt180 -125.84 158.27 35.46 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.023 -0.732 . . . . 2.24 109.023 174.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.2 p -69.84 175.99 3.96 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 109.305 -0.628 . . . . 0.63 109.305 178.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 p -59.89 -38.3 81.85 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.231 -0.588 . . . . 0.96 111.034 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.0 -29.89 24.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.776 0.798 . . . . 2.12 109.36 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 94.66 16.41 42.56 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 114.737 -1.12 . . . . 0.23 112.331 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -69.11 -40.07 78.57 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.433 -0.58 . . . . 1.73 109.433 176.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -87.89 139.42 30.53 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.799 -0.815 . . . . 1.91 108.799 171.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.439 HG22 ' HG2' ' A' ' 30' ' ' ARG . 13.6 p -149.1 137.86 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.811 0.338 . . . . 1.04 110.828 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -144.5 123.16 12.54 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.756 -0.461 . . . . 0.54 109.756 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 49.2 m -112.81 131.94 55.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.732 0.641 . . . . 1.04 112.732 -174.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.489 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -99.31 131.03 47.38 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.597 0 N-CA-C 108.035 -1.098 . . . . 1.04 108.035 168.259 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 45' ' ' ILE . 63.9 t -93.86 121.38 44.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 O-C-N 121.122 -0.986 . . . . 1.02 108.843 171.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.425 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -68.61 -19.77 64.46 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.157 0.799 . . . . 1.01 113.157 -169.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.3 p -69.43 -14.44 62.89 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.05 -0.66 . . . . 1.07 109.681 175.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -109.62 10.54 24.96 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.599 -0.728 . . . . 1.03 110.076 -178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.454 ' HA ' ' HA2' ' A' ' 64' ' ' GLY . 24.6 mm -111.48 141.09 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 108.871 -0.788 . . . . 1.01 108.871 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -106.91 -43.67 4.6 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.908 0.385 . . . . 0.52 110.636 -177.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.447 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 1.0 OUTLIER -134.31 165.81 24.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.042 -0.526 . . . . 1.95 110.744 -174.822 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.501 HD13 HD11 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -150.32 132.35 15.26 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.706 -0.85 . . . . 1.39 108.706 177.816 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -134.91 123.11 22.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.969 -0.382 . . . . 2.02 109.969 -172.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -115.93 143.15 45.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.321 0.509 . . . . 1.05 110.907 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.592 ' HB ' ' OG ' ' A' ' 55' ' ' SER . 62.0 p -61.73 120.78 59.72 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 115.884 -0.598 . . . . 1.05 110.859 -177.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.418 ' HD2' ' HB3' ' A' ' 55' ' ' SER . 24.6 Cg_exo -55.29 157.11 15.0 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.556 2.17 . . . . 0.44 111.445 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.23 -9.03 14.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.854 0.359 . . . . 1.21 111.854 -177.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.9 p -104.76 -9.46 18.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 1.94 111.829 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.592 ' OG ' ' HB ' ' A' ' 51' ' ' THR . 89.5 p -64.83 151.89 44.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.062 0.458 . . . . 1.13 111.092 -178.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.436 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 65.4 mt-10 -59.2 -22.7 61.43 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.823 0.82 . . . . 1.77 110.231 171.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.525 ' HB3' HG22 ' A' ' 51' ' ' THR . 9.9 mptt -101.43 169.42 8.88 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 114.27 -1.332 . . . . 2.18 112.838 -170.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.46 ' O ' ' HG3' ' A' ' 59' ' ' MET . 65.7 mmm -141.44 98.34 3.34 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.474 -1.239 . . . . 1.11 108.109 165.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.512 ' HE3' ' SD ' ' A' ' 88' ' ' MET . 0.0 OUTLIER -157.52 160.31 38.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.685 -0.689 . . . . 1.05 111.346 -169.733 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.482 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.4 tt -131.99 120.38 22.37 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.046 -0.979 . . . . 1.05 108.481 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.523 ' HD3' ' CB ' ' A' ' 88' ' ' MET . 3.6 mmt85 -99.95 131.62 45.8 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 120.992 0.425 . . . . 3.5 110.37 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.549 HD23 HD11 ' A' ' 104' ' ' LEU . 1.4 mm? -112.84 106.44 14.76 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.563 -0.744 . . . . 1.03 109.0 175.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.447 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 4.7 mp -92.32 105.7 16.97 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 120.955 0.407 . . . . 1.11 111.163 -171.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.454 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -63.04 164.36 28.29 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.356 -0.838 . . . . 0.54 112.626 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.401 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.7 mttt . . . . . 0 C--N 1.316 -0.881 0 CA-C-O 121.567 0.699 . . . . 1.08 112.567 -176.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.806 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 22.1 t70 . . . . . 0 C--O 1.215 -0.719 0 N-CA-C 109.292 -0.632 . . . . 3.23 109.292 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.4 -2.65 6.58 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.109 0.411 . . . . 2.39 112.109 -172.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.9 p -80.18 -0.99 38.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.934 0.397 . . . . 3.2 110.716 171.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.806 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.4 ptpt -86.85 39.05 0.83 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.112 -0.495 . . . . 2.95 110.154 173.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.523 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 24.7 mmtm -43.71 113.81 0.56 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.982 -0.554 . . . . 3.72 110.366 -175.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.641 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 56.8 ttt180 -90.71 161.53 15.31 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.075 -1.083 . . . . 4.12 108.075 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 95.7 mttt -135.29 144.97 47.06 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 118.188 0.449 . . . . 4.59 110.053 175.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.457 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER -78.88 179.92 6.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.933 -0.576 . . . . 4.41 109.559 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -56.33 -29.76 61.73 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 111.913 0.338 . . . . 5.69 111.913 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.457 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 17.6 mt-10 -81.22 -40.83 23.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.855 0.359 . . . . 5.38 110.83 -178.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.22 15.47 2.05 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.427 -0.892 . . . . 4.47 112.835 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.527 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 41.0 m-80 -74.04 132.07 41.98 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.664 -0.495 . . . . 4.72 109.664 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -74.48 92.93 2.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.127 0.489 . . . . 4.28 110.028 -178.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.641 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 7.5 m -102.65 99.46 8.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.833 0.825 . . . . 3.51 109.227 -179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.523 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.85 125.57 62.25 Favored Pre-proline 0 C--N 1.312 -1.051 0 CA-C-N 115.886 -0.597 . . . . 2.87 110.492 -176.279 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo . . . . . 0 N--CA 1.459 -0.543 0 C-N-CA 122.852 2.368 . . . . 2.06 111.998 179.813 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 40.3 m-70 . . . . . 0 C--O 1.219 -0.517 0 N-CA-C 109.348 -0.612 . . . . 0.72 109.348 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.523 ' CB ' ' HD3' ' A' ' 61' ' ' ARG . 23.2 ttm -101.92 132.82 47.49 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.374 -0.53 . . . . 1.07 111.261 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -121.66 129.64 52.92 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.252 -0.648 . . . . 0.27 109.252 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.513 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -80.69 153.6 27.79 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 120.943 0.401 . . . . 1.68 110.186 176.687 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.482 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 21.2 m-85 -135.75 166.07 24.12 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.298 0.571 . . . . 0.32 111.195 -175.17 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -114.61 -19.32 11.16 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.198 -0.91 . . . . 2.7 109.869 176.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.425 ' HB2' HG23 ' A' ' 96' ' ' VAL . 18.7 m120 -134.89 123.66 23.79 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.884 -0.598 . . . . 1.16 110.788 -174.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.519 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 14.6 mmm180 -63.04 -34.25 77.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.337 -0.847 . . . . 3.7 112.236 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.4 m -62.16 -34.62 76.74 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.955 0.407 . . . . 1.13 110.777 -178.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.2 t -70.13 -58.01 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-N 116.03 -0.532 . . . . 1.06 110.265 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.519 ' SD ' ' HD2' ' A' ' 94' ' ' ARG . 13.3 ptp -55.32 -38.42 68.69 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.15 -0.477 . . . . 1.02 111.052 -177.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.424 ' N ' ' HG3' ' A' ' 97' ' ' MET . 30.1 t70 -63.9 -45.65 88.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.647 0.261 . . . . 0.34 110.448 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -71.69 -35.25 70.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.088 -0.505 . . . . 1.58 111.887 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 96' ' ' VAL . 28.2 mm -66.95 -57.47 9.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 108.472 -0.936 . . . . 1.01 108.472 175.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 97' ' ' MET . 31.7 ttpt -48.0 -50.39 27.7 Favored 'General case' 0 C--O 1.219 -0.522 0 O-C-N 124.223 0.952 . . . . 1.47 109.899 176.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.674 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 48.1 ttp -48.19 -57.55 5.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.227 -0.897 . . . . 1.02 111.2 177.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.722 ' O ' HG13 ' A' ' 107' ' ' ILE . 45.1 m -58.45 -53.77 54.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.413 -0.358 . . . . 1.04 110.73 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.549 HD11 HD23 ' A' ' 62' ' ' LEU . 22.7 mt -47.21 -53.77 12.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.492 0.663 . . . . 1.04 110.561 176.054 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.409 HE21 ' HA ' ' A' ' 102' ' ' MET . 22.8 mt-30 -53.66 -42.04 67.45 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.611 -1.177 . . . . 1.96 112.372 176.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.674 ' HG3' ' O ' ' A' ' 102' ' ' MET . 36.8 mt-30 -66.03 -31.65 72.67 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.782 0.801 . . . . 3.11 109.194 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.722 HG13 ' O ' ' A' ' 103' ' ' THR . 15.0 mt -77.35 -45.1 29.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 114.597 -1.183 . . . . 1.03 111.289 -177.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.501 HD11 HD13 ' A' ' 48' ' ' LEU . 9.8 mt -65.24 -38.45 82.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.166 -0.47 . . . . 1.04 112.177 -175.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.8 p -59.54 -26.49 65.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.878 0.37 . . . . 1.67 110.986 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -60.63 -50.58 72.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.79 0.805 . . . . 1.99 109.478 173.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -89.96 28.31 1.4 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.71 -1.132 . . . . 1.0 110.1 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.415 ' HE2' ' HA ' ' A' ' 112' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.714 0 N-CA-C 108.036 -1.098 . . . . 1.46 108.036 174.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.555 ' CD2' HG21 ' A' ' 103' ' ' THR . 73.7 m80 . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 112.033 0.383 . . . . 1.08 112.033 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.9 p -157.25 155.7 31.24 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 119.943 -0.703 . . . . 1.78 112.318 -174.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.503 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -173.76 -162.17 25.14 Favored Glycine 0 N--CA 1.439 -1.124 0 CA-C-N 114.627 -1.169 . . . . 0.16 110.438 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -101.39 136.02 41.93 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 117.345 0.573 . . . . 1.04 110.162 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.462 ' HB2' ' HB3' ' A' ' 89' ' ' PHE . . . -147.45 141.15 25.63 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.988 0.423 . . . . 1.02 111.876 -176.028 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 13' ' ' SER . 88.0 mt -105.58 122.26 58.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.147 -0.479 . . . . 1.17 109.937 175.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -127.79 131.2 49.62 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.723 -0.843 . . . . 0.43 108.723 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 60.28 29.62 19.16 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.909 0.484 . . . . 0.8 110.562 -177.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm 65.72 5.78 3.54 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.921 0.711 . . . . 2.57 112.921 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 p -98.49 119.91 47.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.476 -0.935 . . . . 1.1 108.476 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.449 ' HA ' HG12 ' A' ' 8' ' ' ILE . 52.5 p -74.34 144.71 44.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.158 -0.474 . . . . 1.5 110.904 -175.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.403 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.81 -159.57 10.26 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.258 -0.972 . . . . 0.12 113.286 -178.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 19.9 mm -125.93 134.73 65.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 109.107 -0.701 . . . . 1.02 109.107 -178.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.434 HD11 HD13 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.22 135.7 37.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 110.129 -0.323 . . . . 1.05 110.129 -176.572 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.59 129.03 30.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.985 0.421 . . . . 1.04 111.413 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.495 HD12 ' HA ' ' A' ' 3' ' ' HIS . 61.9 mt -85.91 135.37 25.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 109.763 -0.458 . . . . 1.04 109.763 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -108.67 103.28 12.35 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.096 -0.502 . . . . 1.98 111.182 -173.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 28.2 mt-10 -116.79 170.75 8.36 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.46 -0.941 . . . . 1.2 108.46 174.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.8 t70 81.07 -5.97 1.63 Allowed 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 122.428 1.109 . . . . 0.58 109.361 -176.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 23' ' ' SER . 32.7 m -103.33 -174.17 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 CA-C-N 113.753 -1.567 . . . . 1.05 109.943 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.645 ' O ' HG23 ' A' ' 22' ' ' VAL . 57.9 m -73.14 168.67 22.75 Favored Pre-proline 0 C--N 1.313 -1.001 0 N-CA-C 105.423 -2.066 . . . . 1.77 105.423 173.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -41.31 128.13 3.16 Favored 'Trans proline' 0 C--N 1.355 0.885 0 CA-C-N 121.296 1.499 . . . . 0.19 112.642 -143.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.437 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -51.44 141.7 15.14 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 113.993 -1.458 . . . . 1.03 112.563 -165.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.65 168.79 12.67 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 114.228 -1.351 . . . . 0.32 111.922 -170.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.49 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -116.53 107.3 14.57 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.398 -1.334 . . . . 1.02 107.398 172.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.6 m -104.49 106.7 17.3 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 120.878 0.371 . . . . 1.02 110.894 -175.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.7 t90 -85.12 132.34 34.32 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.842 -0.799 . . . . 0.17 108.842 172.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.461 ' HG2' HG22 ' A' ' 37' ' ' VAL . 62.1 mtt180 -127.29 156.97 41.09 Favored 'General case' 0 C--N 1.31 -1.122 0 N-CA-C 108.893 -0.781 . . . . 2.24 108.893 174.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -68.76 176.04 3.25 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.385 -0.598 . . . . 0.63 109.385 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.403 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 9.3 p -60.13 -40.79 91.02 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.162 -0.615 . . . . 0.96 110.421 178.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -76.73 -31.33 57.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.85 0.833 . . . . 2.12 109.157 170.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.405 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 89.63 15.27 58.55 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 114.458 -1.247 . . . . 0.23 111.813 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -64.36 -53.37 49.7 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.288 -0.634 . . . . 1.73 109.288 174.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.0 tttt -76.76 139.28 40.36 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.328 -0.851 . . . . 1.91 108.878 174.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.461 HG22 ' HG2' ' A' ' 30' ' ' ARG . 12.4 p -149.43 138.81 15.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.927 0.394 . . . . 1.04 111.142 -178.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -144.18 126.21 15.45 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.751 -0.463 . . . . 0.54 109.751 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.401 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 30.0 m -114.7 133.22 56.05 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.396 0.517 . . . . 1.04 112.396 -173.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.49 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -101.74 130.05 52.0 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.592 0 N-CA-C 108.125 -1.065 . . . . 1.04 108.125 168.482 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 63.3 t -93.72 121.93 44.77 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 O-C-N 121.194 -0.941 . . . . 1.02 108.801 173.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.427 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -69.35 -18.45 63.8 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.136 0.791 . . . . 1.01 113.136 -169.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.6 p -69.55 -15.47 63.23 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.922 -0.711 . . . . 1.07 109.562 174.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 p -109.84 12.2 24.03 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.464 -0.789 . . . . 1.03 110.013 -178.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.495 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 25.9 mm -111.54 138.91 38.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.991 -0.549 . . . . 1.01 109.659 178.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -100.1 -46.66 5.25 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.824 -0.625 . . . . 0.52 110.563 -177.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.478 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 18.1 mtmt -140.3 174.73 10.22 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.135 0.493 . . . . 1.95 111.442 -176.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.478 ' HG ' ' C ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -152.73 136.07 15.84 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.748 -0.834 . . . . 1.39 108.748 -179.35 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 6.8 mm100 -129.81 122.53 28.94 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 122.282 -0.261 . . . . 2.02 110.463 -175.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.424 ' HB1' ' HD3' ' A' ' 101' ' ' LYS . . . -116.09 140.97 48.74 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 122.052 -0.405 . . . . 1.05 111.279 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 66.6 p -66.97 119.3 63.03 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-N 116.099 -0.5 . . . . 1.05 110.146 -177.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.475 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 26.0 Cg_exo -54.25 159.91 7.28 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 122.721 2.28 . . . . 0.44 111.556 178.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.89 -15.69 63.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.195 -0.457 . . . . 1.21 110.573 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -86.14 -16.82 36.71 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 1.94 110.595 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.475 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 47.4 m -76.79 140.7 40.81 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.845 -0.616 . . . . 1.13 111.019 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -66.56 -18.68 65.5 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.404 -0.817 . . . . 1.77 110.7 176.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.55 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 11.2 mmmm -87.05 151.14 23.5 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.743 -1.117 . . . . 2.18 111.031 -175.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.494 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -124.93 96.57 4.92 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 108.121 -1.066 . . . . 1.11 108.121 169.139 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.55 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.23 155.96 34.77 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.458 0.647 . . . . 1.05 111.899 -174.499 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.49 HD12 ' O ' ' A' ' 97' ' ' MET . 1.6 tt -134.36 119.25 18.4 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.698 -1.137 . . . . 1.05 108.329 175.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.703 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 3.5 mtp180 -102.42 142.78 33.08 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.249 0.547 . . . . 3.5 111.311 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.518 ' HB2' ' HB2' ' A' ' 87' ' ' HIS . 1.2 mm? -121.53 107.81 12.87 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.036 -0.984 . . . . 1.03 109.012 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.654 ' N ' HD13 ' A' ' 63' ' ' ILE . 1.7 mp -90.81 103.67 14.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.773 -0.455 . . . . 1.11 109.773 -172.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.412 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -67.54 151.89 52.39 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 121.394 -0.432 . . . . 0.54 112.885 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.495 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 83.8 mttt . . . . . 0 C--N 1.322 -0.606 0 C-N-CA 122.655 0.382 . . . . 1.08 111.182 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.579 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.3 m-20 . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 107.993 -1.114 . . . . 3.23 107.993 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.68 -1.79 4.18 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.31 0.485 . . . . 2.39 112.31 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.2 p -69.21 -11.26 60.65 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.35 0.595 . . . . 3.2 109.861 168.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -84.69 26.41 0.82 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.399 -0.819 . . . . 2.95 111.382 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.7 mtmt -47.08 113.75 0.73 Allowed 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.432 0.634 . . . . 3.72 109.332 -174.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.418 ' HB3' HG23 ' A' ' 80' ' ' VAL . 72.6 ttt180 -96.85 168.61 10.39 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.692 -1.14 . . . . 4.12 109.069 -167.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 63.9 mttp -133.59 141.47 47.69 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 118.104 0.411 . . . . 4.59 110.185 174.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -82.11 -168.38 1.93 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.902 -0.59 . . . . 4.41 110.695 -177.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -56.84 -31.11 64.45 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.799 0.296 . . . . 5.69 111.799 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.445 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 10.6 mt-10 -86.86 -34.68 19.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.1 0.476 . . . . 5.38 110.444 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.94 18.36 5.15 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.478 -0.868 . . . . 4.47 112.049 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.542 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 30.8 m-80 -75.39 134.8 40.86 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.993 -0.744 . . . . 4.72 108.993 177.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -69.02 92.68 0.53 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.982 0.42 . . . . 4.28 110.235 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.418 HG23 ' HB3' ' A' ' 72' ' ' ARG . 19.0 m -97.22 99.58 9.16 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-O 121.677 0.751 . . . . 3.51 109.574 176.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 1.5 p -85.4 107.38 12.0 Favored Pre-proline 0 C--N 1.317 -0.844 0 N-CA-C 109.354 -0.61 . . . . 2.87 109.354 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo . . . . . 0 C--O 1.234 0.301 0 C-N-CA 123.48 2.786 . . . . 2.06 113.943 -170.868 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.557 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 77.8 m-70 . . . . . 0 C--O 1.217 -0.613 0 N-CA-C 107.541 -1.281 . . . . 0.72 107.541 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.703 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 22.9 ttm -140.97 132.35 26.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 119.135 0.88 . . . . 1.07 111.265 173.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.462 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 8.6 m-85 -122.18 128.74 51.58 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.339 -0.846 . . . . 0.27 109.588 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -81.65 150.57 28.01 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.943 -0.391 . . . . 1.68 109.943 177.251 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.41 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.1 m-85 -130.13 175.73 8.67 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.965 0.412 . . . . 0.32 111.55 -173.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -122.57 -9.53 8.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.715 -0.675 . . . . 2.7 110.494 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.441 ' HB2' HG23 ' A' ' 96' ' ' VAL . 52.6 m-80 -146.16 136.96 24.31 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.237 -0.438 . . . . 1.16 110.087 -179.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.428 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 1.2 mpp_? -70.5 -35.09 73.03 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.905 -0.589 . . . . 3.7 111.544 -178.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.439 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 19.5 m -61.63 -36.34 80.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.801 0.334 . . . . 1.13 110.578 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.605 ' O ' HG12 ' A' ' 100' ' ' ILE . 17.5 t -64.71 -58.2 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 116.203 -0.453 . . . . 1.06 110.499 178.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.49 ' O ' HD12 ' A' ' 60' ' ' LEU . 14.0 ptp -57.59 -39.1 76.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 1.02 110.916 -177.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 97' ' ' MET . 19.5 t70 -65.66 -42.14 91.7 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.641 -0.424 . . . . 0.34 110.208 177.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.439 ' HB2' ' O ' ' A' ' 95' ' ' THR . 1.6 t-20 -68.83 -43.97 74.42 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 123.27 0.356 . . . . 1.58 111.351 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.605 HG12 ' O ' ' A' ' 96' ' ' VAL . 31.4 mm -61.8 -56.58 16.81 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 N-CA-C 108.674 -0.862 . . . . 1.01 108.674 177.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.424 ' HD3' ' HB1' ' A' ' 50' ' ' ALA . 29.8 ttpt -50.81 -48.6 59.67 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.9 0.75 . . . . 1.47 109.864 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.665 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 44.2 ttp -49.35 -54.82 15.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.387 -0.824 . . . . 1.02 111.321 177.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.688 ' O ' HG13 ' A' ' 107' ' ' ILE . 30.0 m -61.92 -51.96 66.0 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.322 -0.399 . . . . 1.04 110.592 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 29.2 mt -46.48 -54.7 8.74 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.835 -0.62 . . . . 1.04 110.17 174.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.478 ' CG ' HD13 ' A' ' 48' ' ' LEU . 90.8 mt-30 -52.17 -43.87 64.34 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.747 -1.115 . . . . 1.96 112.262 176.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.665 ' HG3' ' O ' ' A' ' 102' ' ' MET . 38.0 mt-30 -64.3 -40.65 96.37 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.952 0.882 . . . . 3.11 108.966 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.688 HG13 ' O ' ' A' ' 103' ' ' THR . 7.8 mt -68.88 -42.22 82.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 114.29 -1.323 . . . . 1.03 111.163 -178.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 104' ' ' LEU . 7.2 mt -66.91 -37.64 79.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.413 -0.358 . . . . 1.04 111.471 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.4 t -59.58 -28.85 67.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.699 0.285 . . . . 1.67 110.587 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -59.41 -53.6 56.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.281 -0.637 . . . . 1.99 109.281 173.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -86.99 32.97 0.66 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.2 -0.909 . . . . 1.0 110.265 176.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? . . . . . 0 C--N 1.317 -0.824 0 N-CA-C 107.384 -1.339 . . . . 1.46 107.384 174.394 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.515 ' CD2' HG23 ' A' ' 103' ' ' THR . 74.5 m80 . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 112.015 0.376 . . . . 1.08 112.015 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.1 p -154.27 163.19 40.52 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 119.817 -0.753 . . . . 1.78 112.293 -176.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.434 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 177.0 -158.0 23.41 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 110.424 -1.07 . . . . 0.16 110.424 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.54 135.07 44.83 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 117.386 0.593 . . . . 1.04 110.472 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -147.26 142.74 27.53 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.274 -0.421 . . . . 1.02 111.247 -177.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.754 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 62.3 mt -101.72 126.46 55.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.993 -0.373 . . . . 1.17 109.993 175.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.447 ' O ' HG13 ' A' ' 12' ' ' VAL . 21.2 t80 -129.51 129.92 45.14 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.581 -0.896 . . . . 0.43 108.581 177.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 62.45 29.12 17.1 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 123.386 0.429 . . . . 0.8 110.5 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm 68.52 -0.12 2.38 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.982 0.734 . . . . 2.57 112.982 178.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.7 OUTLIER -92.86 116.86 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 108.228 -1.027 . . . . 1.1 108.228 166.915 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.5 p -73.24 142.27 47.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.29 -0.414 . . . . 1.5 110.42 -176.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.476 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -158.42 -158.17 8.87 Favored Glycine 0 N--CA 1.438 -1.21 0 C-N-CA 119.835 -1.174 . . . . 0.12 113.732 -176.078 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.8 mm -125.98 132.02 71.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.972 -0.614 . . . . 1.02 109.451 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.429 HD12 HD13 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.25 136.38 34.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 110.014 -0.365 . . . . 1.05 110.014 -177.181 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.09 129.84 30.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.9 0.381 . . . . 1.04 111.318 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.505 HD12 ' HA ' ' A' ' 3' ' ' HIS . 65.4 mt -86.25 132.64 31.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 110.011 -0.366 . . . . 1.04 110.011 177.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -105.29 101.88 11.4 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.128 -0.487 . . . . 1.98 110.608 -175.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -116.5 167.95 10.6 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.374 -0.602 . . . . 1.2 109.374 175.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 76.8 -2.56 2.66 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 122.165 0.984 . . . . 0.58 109.964 -175.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.602 HG21 ' O ' ' A' ' 23' ' ' SER . 30.4 m -102.64 -174.52 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.022 0 CA-C-N 114.051 -1.431 . . . . 1.05 109.324 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.602 ' O ' HG21 ' A' ' 22' ' ' VAL . 75.6 m -72.4 167.14 35.36 Favored Pre-proline 0 C--N 1.314 -0.942 0 N-CA-C 105.198 -2.149 . . . . 1.77 105.198 175.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.411 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 94.8 Cg_exo -41.9 127.75 3.78 Favored 'Trans proline' 0 C--N 1.354 0.85 0 CA-C-N 121.213 1.469 . . . . 0.19 112.136 -141.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.475 ' H ' ' HH ' ' A' ' 111' ' ' TYR . . . -52.07 139.32 23.32 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 113.97 -1.468 . . . . 1.03 112.17 -163.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 24' ' ' PRO . 0.7 OUTLIER -125.48 168.44 13.63 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 114.225 -1.352 . . . . 0.32 111.823 -169.847 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.5 ' HB3' HG23 ' A' ' 40' ' ' VAL . 3.3 tm? -116.83 105.42 12.35 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 107.365 -1.346 . . . . 1.02 107.365 174.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.6 m -101.85 107.09 18.17 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 121.061 0.458 . . . . 1.02 111.122 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.9 t90 -85.21 132.04 34.34 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.044 -0.725 . . . . 0.17 109.044 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.557 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 66.2 mtp180 -123.06 163.22 20.92 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 109.039 -0.726 . . . . 2.24 109.039 172.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 p -71.26 177.52 3.83 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 108.95 -0.759 . . . . 0.63 108.95 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.476 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.0 OUTLIER -58.34 -36.68 73.81 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.316 -0.553 . . . . 0.96 111.017 179.684 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -88.98 -31.23 18.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.608 0.718 . . . . 2.12 109.91 171.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.557 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 96.76 16.25 36.96 Favored Glycine 0 N--CA 1.447 -0.613 0 CA-C-N 114.978 -1.01 . . . . 0.23 112.1 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -62.18 -43.47 98.75 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.084 -0.71 . . . . 1.73 109.084 172.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.1 tttt -89.9 141.73 28.37 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.76 -0.83 . . . . 1.91 108.76 174.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.511 HG21 ' HG2' ' A' ' 30' ' ' ARG . 7.9 p -149.4 136.46 13.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.942 0.401 . . . . 1.04 111.272 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -144.28 127.26 16.44 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.634 -0.506 . . . . 0.54 109.634 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.7 m -117.11 132.83 56.58 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.812 0.671 . . . . 1.04 112.812 -173.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.5 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -99.27 130.05 48.81 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.611 0 N-CA-C 108.017 -1.105 . . . . 1.04 108.017 168.693 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.403 ' O ' HG12 ' A' ' 45' ' ' ILE . 57.8 t -93.16 122.31 44.55 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 O-C-N 121.071 -1.018 . . . . 1.02 109.099 173.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.436 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -69.38 -19.38 63.83 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.736 0.643 . . . . 1.01 112.736 -170.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.7 p -69.8 -12.29 61.51 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.366 0.603 . . . . 1.07 109.635 174.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.7 p -112.62 13.8 20.02 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.328 -0.851 . . . . 1.03 109.879 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.521 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 25.5 mm -114.97 144.77 21.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.303 -0.629 . . . . 1.01 109.303 177.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -114.85 -37.39 4.2 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.691 0.281 . . . . 0.52 111.168 -177.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.432 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 9.8 mtmm -139.26 168.8 19.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.732 0.301 . . . . 1.95 111.43 -179.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.446 ' CD2' ' HB3' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -152.04 137.97 18.1 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 109.408 -0.59 . . . . 1.39 109.408 -179.521 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.407 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 8.4 mm100 -134.53 115.21 13.64 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 122.175 -0.328 . . . . 2.02 111.505 -171.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.536 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -114.44 144.41 43.35 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.765 -0.584 . . . . 1.05 112.195 -177.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 69.0 p -68.55 119.66 70.05 Favored Pre-proline 0 C--O 1.233 0.237 0 CA-C-N 115.418 -0.81 . . . . 1.05 110.784 -176.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.84 155.16 14.96 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.798 2.332 . . . . 0.44 111.723 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.6 -17.09 62.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 1.21 112.402 -174.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.5 t -99.81 -7.79 24.99 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.806 0.336 . . . . 1.94 110.766 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.2 m -71.87 138.5 48.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.218 0.532 . . . . 1.13 111.482 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -55.78 -23.66 31.16 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.038 -0.983 . . . . 1.77 111.084 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -88.67 148.55 23.96 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.874 -1.057 . . . . 2.18 111.875 -174.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.634 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -118.87 95.46 4.84 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.12 -1.067 . . . . 1.11 108.12 166.609 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.634 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -157.5 158.56 35.95 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.524 0.678 . . . . 1.05 112.505 -173.793 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.443 ' HG ' ' HB2' ' A' ' 50' ' ' ALA . 1.6 tt -140.67 119.89 12.94 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.651 -1.158 . . . . 1.05 108.318 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.689 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.2 mtp180 -102.53 147.53 26.65 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.426 0.631 . . . . 3.5 112.014 -178.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.54 HD22 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -125.32 105.3 9.0 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.431 -1.259 . . . . 1.03 108.987 178.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.532 ' N ' HD13 ' A' ' 63' ' ' ILE . 3.1 mp -88.91 106.15 16.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 110.137 -0.32 . . . . 1.11 110.137 -174.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.438 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -66.52 166.2 39.05 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.936 -0.575 . . . . 0.54 112.925 -178.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.521 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 83.0 mttt . . . . . 0 C--N 1.317 -0.844 0 CA-C-O 120.861 0.363 . . . . 1.08 111.362 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.566 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 14.0 m-20 . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 108.995 -0.742 . . . . 3.23 108.995 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -69.25 -2.6 11.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.957 0.408 . . . . 2.39 111.42 -174.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.9 p -65.12 -17.33 64.38 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.524 -0.547 . . . . 3.2 109.524 169.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -79.42 132.53 36.41 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.187 0.994 . . . . 2.95 110.528 176.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.4 mmtm -101.4 116.85 33.73 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 114.646 -1.161 . . . . 3.72 109.246 167.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.608 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 41.0 ttm180 -99.33 157.57 16.31 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.463 -0.94 . . . . 4.12 108.463 176.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 50.9 mttp -128.25 147.19 50.58 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.811 -0.441 . . . . 4.59 109.811 174.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.29 -172.86 3.61 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.554 -0.748 . . . . 4.41 110.483 -175.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -58.55 -31.42 67.95 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.093 0.405 . . . . 5.69 112.093 -178.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.578 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 30.8 mt-10 -85.49 -22.69 28.1 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.907 -0.317 . . . . 5.38 110.96 -178.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 105.7 19.11 10.65 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.624 -0.798 . . . . 4.47 112.38 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.578 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 37.9 m-80 -77.88 140.61 39.34 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.383 -0.599 . . . . 4.72 109.383 177.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -74.23 95.67 2.66 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.469 -0.567 . . . . 4.28 109.469 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.608 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.3 m -107.88 98.79 7.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 109.003 -0.739 . . . . 3.51 109.003 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.411 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -89.0 114.55 60.62 Favored Pre-proline 0 C--N 1.316 -0.866 0 CA-C-N 115.892 -0.595 . . . . 2.87 110.375 -175.823 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 25.5 Cg_exo . . . . . 0 CA--C 1.51 -0.721 0 C-N-CA 123.036 2.491 . . . . 2.06 113.716 -174.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.497 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 79.5 m-70 . . . . . 0 C--O 1.218 -0.583 0 N-CA-C 107.505 -1.295 . . . . 0.72 107.505 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.689 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 19.5 ttm -140.74 130.55 24.39 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 118.914 0.779 . . . . 1.07 111.309 175.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.543 ' O ' ' HA ' ' A' ' 59' ' ' MET . 11.6 m-85 -116.61 138.05 51.72 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.371 -0.831 . . . . 0.27 109.614 178.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.754 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -81.06 159.04 24.87 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 109.078 -0.712 . . . . 1.68 109.078 174.381 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.402 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 18.1 m-85 -138.34 175.47 9.55 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.91 0.386 . . . . 0.32 111.478 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -130.63 -0.75 4.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.828 -0.624 . . . . 2.7 110.115 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.405 ' HB2' HG22 ' A' ' 96' ' ' VAL . 62.2 m-80 -147.1 133.55 19.69 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.176 -0.465 . . . . 1.16 110.223 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -72.01 -39.2 69.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.632 -0.713 . . . . 3.7 111.208 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.4 m -60.84 -33.44 73.05 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.994 -0.548 . . . . 1.13 110.696 -177.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.623 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.3 t -67.25 -61.44 1.69 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 CA-C-N 116.052 -0.522 . . . . 1.06 110.247 176.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.434 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.3 ptp -54.69 -38.58 67.18 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.25 -0.432 . . . . 1.02 111.234 -175.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.416 ' O ' ' HB2' ' A' ' 102' ' ' MET . 29.9 t70 -62.98 -47.72 81.93 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.333 -0.394 . . . . 0.34 110.511 177.369 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -68.95 -39.01 79.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.992 -0.549 . . . . 1.58 111.619 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.623 HG12 ' O ' ' A' ' 96' ' ' VAL . 35.7 mm -63.36 -58.92 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 109.039 -0.726 . . . . 1.01 109.039 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.536 ' HD3' ' HB2' ' A' ' 50' ' ' ALA . 14.6 ttpp -51.25 -47.76 62.34 Favored 'General case' 0 CA--C 1.508 -0.64 0 O-C-N 123.795 0.684 . . . . 1.47 109.818 177.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.674 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 37.8 ttp -51.19 -55.28 18.77 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.065 -0.971 . . . . 1.02 110.943 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.726 ' O ' HG13 ' A' ' 107' ' ' ILE . 31.9 m -60.41 -51.74 68.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.284 -0.416 . . . . 1.04 110.455 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 31.7 mt -47.38 -54.96 9.85 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.409 0.684 . . . . 1.04 110.312 175.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -53.7 -39.1 64.9 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.502 -1.226 . . . . 1.96 112.565 178.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.674 ' HG3' ' O ' ' A' ' 102' ' ' MET . 64.5 mt-30 -67.2 -42.46 84.09 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.863 0.839 . . . . 3.11 109.04 177.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.726 HG13 ' O ' ' A' ' 103' ' ' THR . 14.1 mt -64.8 -46.79 90.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.298 -1.319 . . . . 1.03 110.997 -179.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 104' ' ' LEU . 7.6 mt -61.95 -32.22 53.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.841 -0.618 . . . . 1.04 111.222 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.5 t -61.44 -31.51 71.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.488 -0.324 . . . . 1.67 110.399 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -63.57 -40.19 96.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.375 0.607 . . . . 1.99 109.387 175.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.475 ' HH ' ' H ' ' A' ' 25' ' ' ALA . 35.0 m-85 -97.7 18.28 15.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.445 -0.798 . . . . 1.0 110.103 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.627 0 N-CA-C 107.717 -1.216 . . . . 1.46 107.717 175.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.409 ' HA ' HD12 ' A' ' 18' ' ' ILE . 73.1 m80 . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 112.365 0.506 . . . . 1.08 112.365 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.2 p -156.91 166.2 34.02 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.519 0.563 . . . . 1.78 112.519 -171.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.472 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 174.45 -166.67 38.68 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.595 -1.002 . . . . 0.16 110.595 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.3 134.33 36.9 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 117.798 0.799 . . . . 1.04 110.301 178.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.36 144.74 28.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.171 0.51 . . . . 1.02 111.628 -178.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.448 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 98.2 mt -102.79 119.42 51.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.848 -0.615 . . . . 1.17 110.166 176.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.427 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.8 t80 -126.1 137.2 53.59 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 109.142 -0.688 . . . . 0.43 109.142 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 62.07 22.95 13.48 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.522 0.514 . . . . 0.8 109.761 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt 67.92 5.22 4.4 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.279 -0.873 . . . . 2.57 112.764 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.427 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.5 OUTLIER -95.48 126.88 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 108.671 -0.863 . . . . 1.1 108.671 166.447 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.423 ' HA ' HG12 ' A' ' 8' ' ' ILE . 27.3 p -77.35 142.8 39.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.226 0.536 . . . . 1.5 111.049 -175.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.92 -158.59 9.8 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 120.26 -0.971 . . . . 0.12 113.228 -177.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 35.1 mm -125.29 131.41 72.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 109.351 -0.611 . . . . 1.02 109.351 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.424 HD12 HD13 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -101.99 135.07 40.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 120.788 0.327 . . . . 1.05 110.144 -176.726 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.65 130.95 32.98 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.22 -0.446 . . . . 1.04 111.024 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' A' ' 3' ' ' HIS . 34.3 mt -85.03 137.44 20.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.271 0.557 . . . . 1.04 110.171 177.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -109.31 105.05 14.3 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.144 -0.935 . . . . 1.98 111.232 -173.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.473 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -124.05 169.96 11.14 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.168 -0.469 . . . . 1.2 109.744 176.04 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.473 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.6 t70 80.96 -6.12 1.64 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 122.452 1.12 . . . . 0.58 109.293 -173.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.593 HG21 ' O ' ' A' ' 23' ' ' SER . 32.4 m -102.33 -172.48 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-N 113.699 -1.591 . . . . 1.05 109.128 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.593 ' O ' HG21 ' A' ' 22' ' ' VAL . 19.9 m -72.07 167.48 31.42 Favored Pre-proline 0 C--N 1.316 -0.878 0 N-CA-C 105.687 -1.968 . . . . 1.77 105.687 175.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -41.7 127.39 3.47 Favored 'Trans proline' 0 C--N 1.352 0.719 0 CA-C-N 120.81 1.325 . . . . 0.19 112.728 -143.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.453 ' HB1' ' CG2' ' A' ' 107' ' ' ILE . . . -45.22 138.15 4.13 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 113.61 -1.632 . . . . 1.03 112.739 -166.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.55 169.34 12.0 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 113.908 -1.496 . . . . 0.32 111.615 -169.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.493 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.1 tm? -117.81 108.92 15.94 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 107.761 -1.2 . . . . 1.02 107.761 173.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.3 m -104.26 108.26 19.57 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.015 0.436 . . . . 1.02 111.176 -176.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.2 t90 -86.43 130.45 34.5 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.211 -0.662 . . . . 0.17 109.211 172.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.441 ' HG2' HG23 ' A' ' 37' ' ' VAL . 78.1 mtt180 -123.36 157.3 33.62 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 109.027 -0.731 . . . . 2.24 109.027 172.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.2 p -70.38 177.95 3.14 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.486 -0.561 . . . . 0.63 109.486 178.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.2 p -62.45 -38.29 89.21 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.905 -0.718 . . . . 0.96 110.405 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -78.8 -33.01 46.56 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.811 0.815 . . . . 2.12 108.969 171.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.403 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 91.89 10.53 61.3 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 114.459 -1.246 . . . . 0.23 112.637 177.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -65.44 -48.79 71.52 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.586 -0.524 . . . . 1.73 109.586 175.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.4 tttm -77.25 134.31 38.61 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.821 -0.807 . . . . 1.91 108.821 172.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.441 HG23 ' HG2' ' A' ' 30' ' ' ARG . 13.6 p -149.39 136.49 13.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 120.672 0.273 . . . . 1.04 110.701 -177.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -144.49 132.85 21.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.667 0.27 . . . . 0.54 110.316 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.426 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 37.0 m -116.52 133.43 56.02 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.501 0.556 . . . . 1.04 112.501 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.493 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.44 129.8 53.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.599 0 N-CA-C 108.383 -0.969 . . . . 1.04 108.383 169.247 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.6 t -92.53 119.63 40.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 O-C-N 121.207 -0.933 . . . . 1.02 108.805 173.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.445 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.6 mm? -66.94 -18.18 65.26 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.984 0.735 . . . . 1.01 112.984 -170.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.417 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 44.3 t -70.81 -14.94 62.6 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.204 -0.598 . . . . 1.07 109.624 175.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.433 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 3.5 p -109.34 9.97 25.61 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.517 -0.765 . . . . 1.03 110.002 -178.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.457 HG22 ' CD1' ' A' ' 62' ' ' LEU . 31.0 mm -110.36 137.91 40.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.831 -0.622 . . . . 1.01 109.327 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -103.29 -40.22 6.49 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.319 -0.4 . . . . 0.52 110.591 -175.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.585 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 25.2 mtpp -139.79 174.51 10.44 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.406 0.622 . . . . 1.95 111.962 -178.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.517 HD13 ' CG ' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -152.92 137.57 16.9 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.785 -1.098 . . . . 1.39 108.754 176.898 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -134.02 118.41 17.78 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 122.436 -0.165 . . . . 2.02 111.416 -173.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.413 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -117.42 144.09 45.34 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 122.062 -0.399 . . . . 1.05 111.693 -177.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.524 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 74.2 p -70.67 121.28 83.25 Favored Pre-proline 0 N--CA 1.463 0.202 0 CA-C-N 115.884 -0.598 . . . . 1.05 111.162 -175.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.576 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 22.6 Cg_exo -58.41 160.55 16.45 Favored 'Trans proline' 0 CA--C 1.528 0.204 0 C-N-CA 122.866 2.378 . . . . 0.44 111.939 175.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.16 -13.92 62.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 1.21 111.364 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.3 p -91.87 -15.49 28.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.263 0.554 . . . . 1.94 110.547 176.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.576 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 20.9 m -71.85 143.26 49.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.618 -0.719 . . . . 1.13 111.608 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -69.16 -8.32 44.44 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 114.951 -1.022 . . . . 1.77 110.653 176.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.442 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 30.5 mmtm -105.39 155.74 18.84 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 114.79 -1.095 . . . . 2.18 111.121 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.524 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 72.5 mmm -133.0 98.27 4.24 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.174 -0.676 . . . . 1.11 109.174 169.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.558 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.2 OUTLIER -157.88 160.59 37.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.01 -0.541 . . . . 1.05 111.562 -171.037 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.425 HD11 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -136.99 118.77 15.09 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.387 -0.968 . . . . 1.05 108.387 176.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.486 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 2.2 mtp180 -103.64 136.87 42.55 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.211 0.529 . . . . 3.5 111.439 -178.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.572 ' HB2' ' HB2' ' A' ' 87' ' ' HIS . 1.4 mm? -109.03 107.6 18.0 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.055 -0.975 . . . . 1.03 109.243 174.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.585 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.3 mp -85.56 101.7 10.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 110.137 -0.32 . . . . 1.11 110.137 -174.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.25 153.62 50.64 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 116.111 -0.495 . . . . 0.54 112.273 178.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.433 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 86.8 mttt . . . . . 0 C--N 1.319 -0.737 0 CA-C-O 121.129 0.49 . . . . 1.08 111.758 -176.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.831 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 15.2 t70 . . . . . 0 N--CA 1.45 -0.475 0 N-CA-C 107.965 -1.124 . . . . 3.23 107.965 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -75.76 -9.09 58.3 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.773 0.321 . . . . 2.39 110.963 -174.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.1 p -66.87 -9.52 38.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.061 0.458 . . . . 3.2 110.618 174.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.831 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 4.9 ptpp? -86.43 33.3 0.63 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.011 -0.541 . . . . 2.95 110.386 173.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -43.72 113.33 0.5 Allowed 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.474 0.654 . . . . 3.72 109.746 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 73.5 ttt180 -102.07 165.67 11.03 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 114.872 -1.058 . . . . 4.12 109.064 -167.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 85.8 mttt -134.67 150.43 50.63 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.607 -0.516 . . . . 4.59 109.607 171.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.5 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.8 OUTLIER -84.69 -170.85 3.32 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.606 -0.725 . . . . 4.41 110.416 -177.619 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -59.15 -32.13 69.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.772 0.32 . . . . 5.69 111.619 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.5 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 19.4 mt-10 -80.68 -45.13 17.67 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.931 0.396 . . . . 5.38 110.528 -179.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 130.77 17.08 1.55 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.69 -0.767 . . . . 4.47 112.466 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.547 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 36.6 m-80 -76.03 133.7 40.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.703 -0.48 . . . . 4.72 109.703 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.414 ' HA ' ' HG2' ' A' ' 73' ' ' LYS . 43.7 tt0 -71.16 93.76 1.09 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.255 0.55 . . . . 4.28 110.499 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.492 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 28.3 m -98.75 100.17 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-O 121.727 0.775 . . . . 3.51 109.455 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -86.88 107.48 14.37 Favored Pre-proline 0 C--N 1.316 -0.873 0 N-CA-C 108.715 -0.846 . . . . 2.87 108.715 176.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo . . . . . 0 C--O 1.235 0.35 0 C-N-CA 123.535 2.824 . . . . 2.06 113.579 -170.454 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.572 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 57.8 m-70 . . . . . 0 C--O 1.222 -0.381 0 N-CA-C 108.774 -0.824 . . . . 0.72 108.774 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.558 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 23.5 ttm -102.71 125.03 49.3 Favored 'General case' 0 CA--C 1.502 -0.87 0 C-N-CA 120.05 -0.66 . . . . 1.07 111.012 -175.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -112.83 125.33 54.23 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.271 -0.877 . . . . 0.27 109.199 174.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.462 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.07 148.41 29.67 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.828 -0.434 . . . . 1.68 109.828 178.063 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.42 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 19.8 m-85 -130.01 168.57 16.5 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.283 0.563 . . . . 0.32 111.783 -172.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -120.51 -11.11 9.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.143 -0.935 . . . . 2.7 109.833 175.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -136.85 128.67 29.06 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.373 0.606 . . . . 1.16 110.814 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.448 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.2 mmm180 -68.03 -35.91 79.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.117 -0.947 . . . . 3.7 111.881 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.0 m -61.63 -37.97 85.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.783 0.325 . . . . 1.13 110.747 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.586 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.5 t -66.17 -58.41 6.78 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 CA-C-N 116.221 -0.445 . . . . 1.06 110.468 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.456 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 13.0 ptp -55.8 -39.49 71.37 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.333 -0.394 . . . . 1.02 111.286 -176.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.456 ' N ' ' HG3' ' A' ' 97' ' ' MET . 28.7 t70 -65.65 -39.25 91.19 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.87 -0.332 . . . . 0.34 110.332 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -74.44 -40.13 62.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.175 -0.466 . . . . 1.58 111.433 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.6 mm -61.72 -57.23 13.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 108.692 -0.855 . . . . 1.01 108.692 176.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.413 ' HD3' ' HB2' ' A' ' 50' ' ' ALA . 30.0 ttpt -50.66 -49.69 56.43 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 124.09 0.868 . . . . 1.47 109.848 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.466 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.0 ttp -49.98 -52.65 32.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.562 -0.745 . . . . 1.02 111.26 178.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.669 ' O ' HG13 ' A' ' 107' ' ' ILE . 23.3 m -59.68 -56.82 17.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.992 -0.549 . . . . 1.04 110.169 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 26.4 mt -45.6 -54.79 7.13 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.207 -0.906 . . . . 1.04 110.663 176.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.517 ' CG ' HD13 ' A' ' 48' ' ' LEU . 92.9 mt-30 -51.56 -46.33 63.36 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.704 -1.135 . . . . 1.96 112.488 177.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 102' ' ' MET . 17.5 mm100 -67.14 -34.77 78.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.46 0.648 . . . . 3.11 109.968 -179.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.669 HG13 ' O ' ' A' ' 103' ' ' THR . 7.3 mt -71.35 -46.25 65.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 114.669 -1.15 . . . . 1.03 110.924 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 104' ' ' LEU . 6.3 mt -59.24 -42.13 86.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.255 -0.43 . . . . 1.04 111.287 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.0 t -57.09 -28.33 62.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.5 -0.318 . . . . 1.67 111.12 -177.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -60.95 -39.0 87.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.408 0.623 . . . . 1.99 109.938 176.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.417 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 21.0 m-85 -94.47 -16.23 23.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.265 -0.88 . . . . 1.0 110.205 -178.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.568 0 CA-C-N 115.527 -0.761 . . . . 1.46 109.039 176.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.55 ' HA ' HD11 ' A' ' 18' ' ' ILE . 77.2 m80 . . . . . 0 C--O 1.22 -0.473 0 N-CA-C 112.304 0.483 . . . . 1.08 112.304 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.8 p -157.78 161.77 38.45 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 119.72 -0.792 . . . . 1.78 112.376 -175.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.477 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.02 -165.72 34.84 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 115.009 -0.996 . . . . 0.16 110.749 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.19 130.55 45.51 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.23 0.515 . . . . 1.04 110.44 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.63 143.58 30.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.043 0.449 . . . . 1.02 111.351 -177.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.403 HG12 ' HA ' ' A' ' 13' ' ' SER . 74.2 mt -99.23 128.27 51.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.647 -0.501 . . . . 1.17 109.647 174.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.51 ' O ' HG13 ' A' ' 12' ' ' VAL . 15.0 t80 -139.31 138.55 36.79 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.992 -0.744 . . . . 0.43 108.992 178.022 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 64.35 24.88 13.34 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.65 0.594 . . . . 0.8 109.494 -176.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp 65.72 1.02 1.64 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 114.992 -1.004 . . . . 2.57 113.027 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.51 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -94.53 130.06 43.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.863 -0.791 . . . . 1.1 108.863 168.688 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.403 ' HA ' HG12 ' A' ' 8' ' ' ILE . 20.4 m -78.68 144.08 35.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.824 0.345 . . . . 1.5 110.609 -175.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.34 -158.97 9.92 Favored Glycine 0 N--CA 1.439 -1.148 0 C-N-CA 119.92 -1.133 . . . . 0.12 113.743 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.4 mm -127.59 134.53 65.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.862 -0.792 . . . . 1.02 108.862 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -104.97 136.91 36.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.603 -0.271 . . . . 1.05 110.337 -176.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.68 130.03 31.52 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.911 0.386 . . . . 1.04 111.436 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.55 HD11 ' HA ' ' A' ' 3' ' ' HIS . 64.3 mt -86.2 135.45 25.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.308 -0.405 . . . . 1.04 110.022 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -106.75 103.36 12.78 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.005 -0.543 . . . . 1.98 110.902 -175.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.41 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 21.1 mt-10 -119.2 169.47 9.93 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.81 -0.811 . . . . 1.2 108.81 175.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 36.3 t70 78.97 -2.25 2.28 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.445 1.117 . . . . 0.58 109.443 -176.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 23' ' ' SER . 34.8 m -104.0 -173.01 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-N 113.675 -1.602 . . . . 1.05 110.314 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.623 ' O ' HG22 ' A' ' 22' ' ' VAL . 75.6 m -72.06 167.63 30.02 Favored Pre-proline 0 C--N 1.316 -0.889 0 N-CA-C 105.23 -2.137 . . . . 1.77 105.23 172.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -41.77 129.06 3.93 Favored 'Trans proline' 0 C--N 1.355 0.917 0 CA-C-N 121.345 1.516 . . . . 0.19 112.577 -144.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.438 ' HB1' ' CG2' ' A' ' 107' ' ' ILE . . . -52.77 142.64 18.31 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 114.124 -1.398 . . . . 1.03 112.336 -163.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.26 169.11 13.86 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 114.332 -1.304 . . . . 0.32 111.787 -169.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.5 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.2 tm? -120.75 105.5 10.8 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.803 -1.184 . . . . 1.02 107.803 174.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.9 m -102.48 107.5 18.49 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 121.072 0.463 . . . . 1.02 111.414 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.8 t90 -85.17 132.32 34.31 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.222 -0.659 . . . . 0.17 109.222 172.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HG2' HG22 ' A' ' 37' ' ' VAL . 63.7 mtt180 -125.75 159.37 32.53 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 108.92 -0.77 . . . . 2.24 108.92 173.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 p -69.25 176.44 3.3 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 109.31 -0.626 . . . . 0.63 109.31 178.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.8 p -57.87 -41.39 82.34 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.403 -0.519 . . . . 0.96 111.205 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.86 -32.09 21.89 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.389 -0.597 . . . . 2.12 109.389 171.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.01 17.33 23.16 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.457 -0.792 . . . . 0.23 113.84 172.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.77 -44.36 77.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.253 0.526 . . . . 1.73 109.752 174.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.6 tttm -82.98 137.22 34.25 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.644 -0.872 . . . . 1.91 108.644 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.425 HG22 ' HG2' ' A' ' 30' ' ' ARG . 12.4 p -149.89 138.49 14.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.799 0.333 . . . . 1.04 111.432 -176.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -143.98 126.45 15.88 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.618 -0.512 . . . . 0.54 109.618 176.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.437 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 92.2 m -111.64 136.44 50.86 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.135 0.42 . . . . 1.04 112.135 -176.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.5 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.37 128.61 57.73 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.704 0 N-CA-C 108.154 -1.054 . . . . 1.04 108.154 169.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.425 ' O ' HG12 ' A' ' 45' ' ' ILE . 70.5 t -92.73 121.62 43.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 O-C-N 121.108 -0.995 . . . . 1.02 108.773 173.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.439 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -69.8 -17.08 63.39 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.923 0.712 . . . . 1.01 112.923 -169.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.9 p -72.04 -11.63 60.85 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.205 -0.598 . . . . 1.07 109.557 174.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 p -111.4 9.09 21.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.615 -0.721 . . . . 1.03 109.711 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.493 HG22 ' CD1' ' A' ' 62' ' ' LEU . 25.8 mm -113.33 141.49 28.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 108.963 -0.754 . . . . 1.01 108.963 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -107.08 -44.69 4.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.982 0.42 . . . . 0.52 110.489 -179.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.584 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 24.5 mtpp -133.0 172.16 13.0 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-O 121.711 0.767 . . . . 1.95 111.895 -175.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.568 ' HG ' ' C ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -153.28 138.93 17.84 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.332 -1.304 . . . . 1.39 108.284 178.414 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -137.23 118.56 14.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 117.736 0.244 . . . . 2.02 110.914 -173.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.459 ' HB3' ' SD ' ' A' ' 97' ' ' MET . . . -115.04 141.6 47.77 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.715 0.293 . . . . 1.05 111.358 -177.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.476 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 73.3 p -65.68 120.29 67.31 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 115.764 -0.653 . . . . 1.05 111.01 -176.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.55 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 10.4 Cg_exo -60.42 161.51 20.19 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.395 2.063 . . . . 0.44 111.54 176.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.09 -21.48 65.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 1.21 110.92 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.4 p -78.81 -18.17 54.52 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.917 -0.583 . . . . 1.94 110.614 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.55 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 37.8 m -75.93 139.53 41.64 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.701 -0.681 . . . . 1.13 111.143 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.36 -11.92 46.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.129 -0.941 . . . . 1.77 110.712 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.468 ' HG2' ' HE1' ' A' ' 59' ' ' MET . 9.5 mptt -102.5 155.39 18.3 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 114.748 -1.115 . . . . 2.18 111.783 -174.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.492 ' CE ' ' HE1' ' A' ' 97' ' ' MET . 71.9 mmm -130.77 99.38 4.92 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.359 -0.837 . . . . 1.11 109.296 170.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.514 ' HE2' ' SD ' ' A' ' 88' ' ' MET . 0.6 OUTLIER -156.06 157.65 36.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.751 -0.659 . . . . 1.05 111.674 -173.224 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.458 HD11 ' O ' ' A' ' 97' ' ' MET . 1.7 tt -132.01 119.31 20.89 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 108.353 -0.98 . . . . 1.05 108.353 176.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 88' ' ' MET . 54.9 mtm180 -101.62 140.58 35.72 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 120.849 0.357 . . . . 3.5 111.075 -178.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.537 HD22 HD11 ' A' ' 104' ' ' LEU . 1.3 mm? -116.72 105.25 12.2 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.429 -0.805 . . . . 1.03 109.403 175.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.584 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.5 mp -86.03 107.78 16.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 122.551 0.34 . . . . 1.11 110.317 -173.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -62.26 164.11 24.94 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.989 -0.624 . . . . 0.54 112.621 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 74.4 mttt . . . . . 0 C--N 1.318 -0.794 0 CA-C-O 121.237 0.541 . . . . 1.08 111.687 -179.831 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.67 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 36.6 m-20 . . . . . 0 CA--C 1.51 -0.593 0 N-CA-C 108.569 -0.9 . . . . 3.23 108.569 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -68.42 -1.29 6.17 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.128 0.418 . . . . 2.39 112.128 -171.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.0 p -67.33 -17.9 64.95 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.344 0.592 . . . . 3.2 109.789 169.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -78.65 32.65 0.2 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.41 -0.814 . . . . 2.95 111.183 178.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.0 mmmt -45.67 113.87 0.67 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.087 -0.708 . . . . 3.72 109.087 -175.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.535 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 36.0 ttm180 -105.55 165.49 11.11 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 115.78 -0.646 . . . . 4.12 109.289 -169.262 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.574 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 96.7 mttt -136.93 140.78 42.51 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.669 -0.493 . . . . 4.59 109.669 173.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -86.26 -165.04 1.14 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.221 -0.445 . . . . 4.41 110.587 -176.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -60.95 -30.83 70.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 5.69 111.317 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -82.95 -21.96 33.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.801 0.334 . . . . 5.38 110.739 -177.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.99 14.19 37.35 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.139 -0.784 . . . . 4.47 111.139 -175.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.574 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 80.0 m-20 -69.63 132.34 46.03 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 109.23 -0.655 . . . . 4.72 109.23 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -70.73 92.91 0.9 Allowed 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.348 -0.612 . . . . 4.28 109.348 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.535 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 17.4 m -101.22 98.62 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 CA-C-O 121.725 0.774 . . . . 3.51 109.418 177.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.438 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -85.65 102.69 2.76 Favored Pre-proline 0 C--N 1.314 -0.965 0 N-CA-C 108.366 -0.976 . . . . 2.87 108.366 175.229 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 46.5 Cg_exo . . . . . 0 CA--C 1.516 -0.39 0 C-N-CA 123.357 2.705 . . . . 2.06 113.478 -165.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 54.9 m-70 . . . . . 0 C--O 1.219 -0.54 0 N-CA-C 108.96 -0.755 . . . . 0.72 108.96 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.514 ' SD ' ' HE2' ' A' ' 59' ' ' MET . 30.5 ttm -107.51 125.76 51.68 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 119.795 -0.762 . . . . 1.07 111.254 -176.36 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -114.05 129.1 56.63 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.263 -0.88 . . . . 0.27 109.498 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.46 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.24 149.31 29.08 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.076 0.465 . . . . 1.68 110.275 178.041 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.7 m-85 -132.06 173.81 10.83 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.932 -0.576 . . . . 0.32 110.682 -175.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . 0.566 ' C ' HD21 ' A' ' 93' ' ' ASN . 8.9 t-20 -123.11 -20.89 5.59 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.953 -0.567 . . . . 2.7 110.116 174.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.566 HD21 ' C ' ' A' ' 92' ' ' ASN . 0.9 OUTLIER -126.33 123.44 38.03 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.054 0.454 . . . . 1.16 110.786 -177.249 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.476 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 15.4 mmm180 -60.77 -33.31 72.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.504 -0.771 . . . . 3.7 112.654 179.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.8 m -64.38 -37.96 89.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.786 0.327 . . . . 1.13 110.819 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.615 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.4 t -66.23 -56.19 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 CA-C-N 116.299 -0.41 . . . . 1.06 110.489 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.492 ' HE1' ' CE ' ' A' ' 58' ' ' MET . 10.8 ptp -57.24 -39.28 75.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.97 -0.559 . . . . 1.02 110.828 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.476 ' N ' ' HG3' ' A' ' 97' ' ' MET . 32.4 t70 -66.63 -41.06 88.91 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 120.722 -0.391 . . . . 0.34 110.451 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -69.22 -44.11 72.72 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.114 0.259 . . . . 1.58 111.08 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 96' ' ' VAL . 31.7 mm -61.09 -57.76 10.67 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 108.81 -0.811 . . . . 1.01 108.81 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.526 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 29.5 ttpt -50.83 -48.39 59.91 Favored 'General case' 0 C--O 1.215 -0.75 0 O-C-N 123.927 0.767 . . . . 1.47 109.863 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.696 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 41.5 ttp -49.09 -56.99 7.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.716 -0.674 . . . . 1.02 111.077 177.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.722 ' O ' HG13 ' A' ' 107' ' ' ILE . 26.0 m -58.72 -51.96 67.73 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.468 0.48 . . . . 1.04 110.473 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.537 HD11 HD22 ' A' ' 62' ' ' LEU . 29.1 mt -48.48 -54.03 15.76 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 123.451 0.701 . . . . 1.04 110.613 175.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.534 ' HG2' HD12 ' A' ' 48' ' ' LEU . 44.9 mt-30 -50.56 -44.99 56.83 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.701 -1.136 . . . . 1.96 111.825 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.696 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.9 mt-30 -63.29 -42.21 99.06 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 122.001 0.905 . . . . 3.11 108.986 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.722 HG13 ' O ' ' A' ' 103' ' ' THR . 10.2 mt -66.1 -45.98 89.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 114.1 -1.409 . . . . 1.03 111.311 -178.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 104' ' ' LEU . 9.0 mt -64.21 -40.77 90.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.218 -0.446 . . . . 1.04 111.493 -178.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.4 t -58.54 -23.3 57.98 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.383 -0.371 . . . . 1.67 110.965 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -66.1 -52.14 51.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.427 0.632 . . . . 1.99 109.652 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -79.01 -11.67 60.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.475 -0.784 . . . . 1.0 110.441 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.604 0 N-CA-C 108.747 -0.834 . . . . 1.46 108.747 173.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.499 ' HA ' HD12 ' A' ' 18' ' ' ILE . 76.4 m80 . . . . . 0 CA--C 1.512 -0.495 0 N-CA-C 110.734 -0.098 . . . . 1.08 110.734 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 t -152.53 149.08 28.12 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 118.885 -1.126 . . . . 1.78 113.928 -170.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.477 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -169.28 -172.13 35.65 Favored Glycine 0 N--CA 1.439 -1.111 0 CA-C-N 113.668 -1.605 . . . . 0.16 109.745 177.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -91.53 132.38 36.32 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 117.834 0.817 . . . . 1.04 110.323 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.426 ' HB2' ' HB3' ' A' ' 89' ' ' PHE . . . -144.12 146.6 32.89 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.196 -0.456 . . . . 1.02 111.435 -177.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.503 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 98.3 mt -107.47 123.75 62.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.281 -0.418 . . . . 1.17 110.706 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.457 ' O ' HG11 ' A' ' 12' ' ' VAL . 20.0 t80 -127.19 137.54 52.95 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.305 -0.998 . . . . 0.43 108.305 177.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 58.35 26.24 13.8 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 122.775 0.43 . . . . 0.8 110.919 -178.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.4 mtmm 68.61 0.08 2.49 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.521 0.728 . . . . 2.57 112.915 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.457 HG11 ' O ' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -92.4 116.82 34.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 108.53 -0.915 . . . . 1.1 108.53 169.014 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.41 ' HA ' HG12 ' A' ' 8' ' ' ILE . 50.2 p -70.92 145.18 50.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.114 0.483 . . . . 1.5 110.791 -176.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.0 -160.42 10.7 Favored Glycine 0 N--CA 1.436 -1.366 0 C-N-CA 120.297 -0.954 . . . . 0.12 113.087 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 23.0 mm -125.27 132.28 71.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.122 -0.695 . . . . 1.02 109.122 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.439 HD13 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -100.82 136.1 33.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 N-CA-C 109.856 -0.424 . . . . 1.05 109.856 -176.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.9 125.83 24.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.921 0.391 . . . . 1.04 111.523 -179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.5 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 74.5 mt -85.28 132.8 30.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.779 -0.452 . . . . 1.04 109.779 177.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -102.98 102.29 12.33 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.967 -0.56 . . . . 1.98 110.792 -174.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.432 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 13.5 mt-10 -116.02 170.16 8.7 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.256 -0.646 . . . . 1.2 109.256 176.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.432 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 35.5 t70 78.21 -4.59 2.18 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 122.394 1.092 . . . . 0.58 109.704 -176.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 23' ' ' SER . 32.5 m -103.15 -172.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-N 113.765 -1.561 . . . . 1.05 110.028 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.661 ' O ' HG23 ' A' ' 22' ' ' VAL . 58.2 m -72.89 169.65 16.65 Favored Pre-proline 0 C--N 1.315 -0.898 0 N-CA-C 105.686 -1.968 . . . . 1.77 105.686 173.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -41.96 129.21 4.19 Favored 'Trans proline' 0 C--N 1.359 1.126 0 CA-C-N 121.538 1.585 . . . . 0.19 112.328 -145.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.97 141.99 37.52 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 114.262 -1.335 . . . . 1.03 112.051 -161.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -123.47 168.94 11.9 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.568 -1.196 . . . . 0.32 111.915 -169.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.49 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.2 tm? -120.08 105.28 10.86 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 107.69 -1.226 . . . . 1.02 107.69 173.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 m -100.91 106.81 18.19 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 116.554 -0.294 . . . . 1.02 110.854 -176.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.4 ' HZ2' ' O ' ' A' ' 12' ' ' VAL . 83.8 t90 -85.07 130.41 34.62 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.98 -0.748 . . . . 0.17 108.98 171.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 58.0 mtt180 -126.46 155.2 42.62 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.067 -0.716 . . . . 2.24 109.067 174.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -69.0 176.19 3.29 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 109.634 -0.506 . . . . 0.63 109.634 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.7 p -61.24 -32.42 72.21 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.224 -0.59 . . . . 0.96 110.272 177.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -86.65 -31.64 20.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.674 0.749 . . . . 2.12 108.981 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.445 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 88.62 9.97 68.16 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.573 -1.194 . . . . 0.23 112.498 176.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -64.14 -48.42 76.13 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.795 -0.817 . . . . 1.73 108.795 173.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -77.35 136.1 38.42 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.284 -0.871 . . . . 1.91 109.134 173.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.414 HG21 ' HG2' ' A' ' 30' ' ' ARG . 11.6 p -150.15 139.24 15.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 120.739 0.304 . . . . 1.04 111.089 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -144.47 121.43 11.35 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.659 -0.497 . . . . 0.54 109.659 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.432 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 32.3 m -109.47 133.23 53.34 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.194 0.442 . . . . 1.04 112.194 -175.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.11 129.23 53.81 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.702 0 N-CA-C 108.253 -1.017 . . . . 1.04 108.253 169.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.4 t -92.92 121.77 43.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 O-C-N 121.036 -1.04 . . . . 1.02 108.769 173.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.408 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -68.67 -20.88 64.46 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.151 0.797 . . . . 1.01 113.151 -169.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.1 p -68.62 -14.56 63.09 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.159 -0.616 . . . . 1.07 109.735 174.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.3 p -111.1 14.86 21.84 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.568 -0.742 . . . . 1.03 109.703 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.449 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 24.1 mm -113.08 138.73 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 115.641 -0.709 . . . . 1.01 109.217 176.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -104.15 -40.53 6.12 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.204 -0.453 . . . . 0.52 110.51 -176.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.444 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 11.2 mtmm -141.62 170.64 15.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.325 -0.398 . . . . 1.95 110.93 -177.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.492 HD11 HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -149.69 141.66 23.84 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.498 -0.927 . . . . 1.39 108.498 176.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.473 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 18.0 mm-40 -136.77 114.7 11.38 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 117.362 0.074 . . . . 2.02 111.069 -171.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.42 ' HB1' ' HD3' ' A' ' 101' ' ' LYS . . . -113.34 142.72 45.53 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.98 -0.45 . . . . 1.05 111.229 -179.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.425 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 34.8 p -62.01 122.32 71.44 Favored Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 115.822 -0.626 . . . . 1.05 110.985 -176.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.536 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 15.1 Cg_exo -59.21 159.6 21.97 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.554 2.169 . . . . 0.44 111.303 177.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.19 -14.81 63.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 1.21 110.857 -179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 p -85.84 -17.19 36.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.631 -0.713 . . . . 1.94 110.845 176.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.536 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 45.2 m -78.73 135.67 37.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.717 -0.674 . . . . 1.13 111.133 -179.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -56.44 -34.44 66.84 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.333 -0.849 . . . . 1.77 110.061 172.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.505 ' HG2' ' HE3' ' A' ' 59' ' ' MET . 8.3 mptt -76.25 152.12 36.61 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 113.992 -1.458 . . . . 2.18 111.927 -174.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.445 ' HE2' ' HE2' ' A' ' 97' ' ' MET . 85.7 mmm -129.48 98.55 4.89 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.304 -0.862 . . . . 1.11 108.691 171.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.505 ' HE3' ' HG2' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -154.07 153.84 32.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.882 -0.599 . . . . 1.05 111.53 -172.069 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 97' ' ' MET . 1.8 tt -130.33 118.91 21.99 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.342 -0.984 . . . . 1.05 108.342 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.634 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 1.6 mtp180 -103.41 149.21 25.02 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.458 0.647 . . . . 3.5 111.775 -178.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.536 ' HB2' ' HB2' ' A' ' 87' ' ' HIS . 1.4 mm? -127.65 104.98 8.16 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.38 -1.282 . . . . 1.03 108.901 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.56 HD11 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -88.3 105.0 15.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 110.196 -0.298 . . . . 1.11 110.196 -173.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.417 ' HA2' HD12 ' A' ' 45' ' ' ILE . . . -62.69 160.45 33.37 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 116.181 -0.463 . . . . 0.54 112.464 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.449 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.2 mttt . . . . . 0 C--N 1.316 -0.861 0 CA-C-O 121.654 0.74 . . . . 1.08 112.664 -177.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.793 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 20.9 t70 . . . . . 0 C--O 1.211 -0.955 0 N-CA-C 109.208 -0.664 . . . . 3.23 109.208 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.61 -4.52 4.23 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.865 0.691 . . . . 2.39 112.865 -170.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.57 -1.65 47.1 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.092 0.472 . . . . 3.2 110.673 172.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.793 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.2 ptmt -81.39 40.14 0.55 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.92 -0.582 . . . . 2.95 110.331 172.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.486 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 25.1 mmtm -43.53 114.32 0.62 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.705 -0.68 . . . . 3.72 110.665 -173.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.567 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 44.9 ttt180 -95.57 162.92 13.43 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 108.093 -1.077 . . . . 4.12 108.093 -175.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 20.0 mtpt -128.29 132.81 48.67 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.182 -0.673 . . . . 4.59 109.182 172.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -77.37 -171.92 2.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.63 -0.713 . . . . 4.41 110.696 -174.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -59.52 -32.05 69.94 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.775 0.287 . . . . 5.69 111.775 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.492 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 25.0 mt-10 -83.71 -19.06 35.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.031 0.443 . . . . 5.38 110.926 -179.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.434 ' O ' ' HE2' ' A' ' 73' ' ' LYS . . . 95.89 31.19 7.48 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.953 -0.567 . . . . 4.47 112.753 178.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.564 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 39.7 m-80 -92.35 148.17 22.34 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.046 -0.724 . . . . 4.72 109.046 175.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -72.55 89.38 1.28 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.11 0.481 . . . . 4.28 109.778 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.567 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 12.3 m -99.36 99.31 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.983 0 CA-C-O 121.884 0.849 . . . . 3.51 109.076 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.486 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.4 OUTLIER -85.22 119.38 72.33 Favored Pre-proline 0 C--N 1.31 -1.121 0 CA-C-N 115.601 -0.727 . . . . 2.87 109.994 -178.597 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 52.8 Cg_exo . . . . . 0 CA--C 1.513 -0.573 0 C-N-CA 122.638 2.225 . . . . 2.06 112.274 -178.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.573 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 80.3 m-70 . . . . . 0 C--O 1.216 -0.673 0 N-CA-C 107.415 -1.328 . . . . 0.72 107.415 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.634 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 8.1 ttm -141.1 125.49 17.6 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 119.049 0.84 . . . . 1.07 110.931 176.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.426 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 6.6 m-85 -116.84 127.95 54.79 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.356 -0.838 . . . . 0.27 109.654 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.503 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -80.93 150.72 28.88 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.717 0.294 . . . . 1.68 110.356 178.222 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.42 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 28.2 m-85 -133.46 175.47 9.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.515 0.674 . . . . 0.32 111.649 -174.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -111.24 -29.44 7.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.952 -1.022 . . . . 2.7 110.998 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -138.13 142.89 40.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.003 0.43 . . . . 1.16 110.502 -177.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.56 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 11.0 mmm180 -64.99 -34.23 77.94 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.48 -0.782 . . . . 3.7 111.011 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 57.0 m -58.74 -39.28 80.45 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.115 -0.493 . . . . 1.13 110.626 -176.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 100' ' ' ILE . 9.7 t -67.15 -55.91 15.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.184 -0.462 . . . . 1.06 110.026 177.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.56 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 14.0 ptp -61.86 -41.34 97.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 1.02 111.237 -177.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.427 ' N ' ' HG3' ' A' ' 97' ' ' MET . 36.4 t70 -62.34 -37.1 84.36 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.394 -0.522 . . . . 0.34 110.504 178.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -74.08 -43.46 57.62 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.332 -0.395 . . . . 1.58 111.618 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.561 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 30.8 mm -63.71 -55.02 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 N-CA-C 108.962 -0.755 . . . . 1.01 108.962 176.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.493 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 29.8 ttpt -51.53 -45.48 62.98 Favored 'General case' 0 C--O 1.217 -0.609 0 O-C-N 123.574 0.546 . . . . 1.47 109.783 177.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.618 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 38.8 ttp -50.91 -59.8 3.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.839 -0.619 . . . . 1.02 111.308 177.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.793 ' O ' HG13 ' A' ' 107' ' ' ILE . 27.6 m -56.5 -49.77 73.75 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 123.471 0.482 . . . . 1.04 110.263 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 30.9 mt -48.48 -55.32 11.28 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 123.026 0.53 . . . . 1.04 110.579 174.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 101' ' ' LYS . 45.0 mt-30 -54.22 -42.41 69.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.141 -0.936 . . . . 1.96 111.712 176.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.618 ' HG3' ' O ' ' A' ' 102' ' ' MET . 21.4 mt-30 -64.71 -28.64 69.73 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.769 0.795 . . . . 3.11 109.457 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.793 HG13 ' O ' ' A' ' 103' ' ' THR . 10.7 mt -84.52 -45.34 17.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.672 -1.149 . . . . 1.03 111.232 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 104' ' ' LEU . 9.8 mt -63.24 -38.81 83.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.28 -0.418 . . . . 1.04 111.582 -177.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.409 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 4.7 p -57.75 -26.87 62.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.41 -0.359 . . . . 1.67 111.351 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -62.6 -47.18 84.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.413 0.625 . . . . 1.99 109.557 174.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -89.67 8.18 32.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.548 -0.751 . . . . 1.0 110.186 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.409 ' CB ' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.516 0 N-CA-C 108.631 -0.877 . . . . 1.46 108.631 176.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.571 ' HA ' HD11 ' A' ' 18' ' ' ILE . 77.8 m80 . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 112.835 0.68 . . . . 1.08 112.835 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.3 t -156.74 159.17 38.07 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 119.773 -0.771 . . . . 1.78 112.131 -174.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.512 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.18 -168.82 39.78 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 114.478 -1.237 . . . . 0.16 110.099 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.7 131.93 39.99 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 117.49 0.645 . . . . 1.04 110.398 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.406 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -142.36 144.82 33.35 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.133 0.492 . . . . 1.02 111.561 -177.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.6 mt -111.52 119.45 59.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.883 -0.599 . . . . 1.17 110.258 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -120.65 137.37 54.49 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.717 -0.846 . . . . 0.43 108.717 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 54.74 26.57 7.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 122.737 0.415 . . . . 0.8 111.019 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp 68.37 5.34 4.7 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.825 0.676 . . . . 2.57 112.825 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.5 p -94.9 116.54 36.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 108.216 -1.031 . . . . 1.1 108.216 166.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.9 m -73.0 144.71 47.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.023 0.439 . . . . 1.5 111.077 -175.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.0 -158.43 9.32 Favored Glycine 0 N--CA 1.437 -1.257 0 C-N-CA 120.686 -0.769 . . . . 0.12 112.803 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -125.95 134.62 66.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.184 -0.673 . . . . 1.02 109.184 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.448 HD11 HD11 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.14 135.34 39.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.983 -0.377 . . . . 1.05 109.983 -177.053 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.75 127.86 27.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.948 0.404 . . . . 1.04 111.518 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.571 HD11 ' HA ' ' A' ' 3' ' ' HIS . 65.6 mt -86.02 133.75 28.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.169 -0.469 . . . . 1.04 109.94 177.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -106.31 102.01 11.45 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.822 -0.626 . . . . 1.98 110.784 -174.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -116.28 169.35 9.36 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.189 -0.671 . . . . 1.2 109.189 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t70 76.7 -2.23 2.73 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 122.413 1.101 . . . . 0.58 109.737 -176.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' ' 23' ' ' SER . 33.3 m -103.47 -173.71 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 113.743 -1.572 . . . . 1.05 109.959 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.636 ' O ' HG23 ' A' ' 22' ' ' VAL . 59.5 m -72.96 168.56 23.48 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 105.306 -2.109 . . . . 1.77 105.306 173.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.683 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 72.9 Cg_exo -40.7 128.32 2.58 Favored 'Trans proline' 0 C--N 1.356 0.941 0 CA-C-N 121.55 1.589 . . . . 0.19 112.821 -143.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.86 140.08 25.36 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 114.357 -1.292 . . . . 1.03 112.039 -164.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -126.47 168.92 13.56 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.597 -1.183 . . . . 0.32 112.076 -168.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.491 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.1 tm? -120.25 104.24 9.9 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 107.375 -1.343 . . . . 1.02 107.375 174.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.7 m -101.69 107.87 19.23 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.07 0.462 . . . . 1.02 111.116 -176.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -85.1 131.78 34.4 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.973 -0.751 . . . . 0.17 108.973 172.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.434 ' HG2' HG22 ' A' ' 37' ' ' VAL . 96.3 mtt180 -126.2 158.15 36.38 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.156 -0.683 . . . . 2.24 109.156 173.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -69.73 174.55 5.02 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.226 -0.657 . . . . 0.63 109.226 178.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.6 p -60.96 -35.52 76.97 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 119.93 -0.708 . . . . 0.96 110.504 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -85.58 -29.34 24.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.613 0.721 . . . . 2.12 109.5 173.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.404 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 90.78 16.76 54.08 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 114.843 -1.072 . . . . 0.23 112.68 175.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -69.1 -51.41 38.82 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.954 -0.758 . . . . 1.73 108.954 173.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.8 tttt -75.72 136.01 40.35 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.9 -0.778 . . . . 1.91 108.9 173.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.434 HG22 ' HG2' ' A' ' 30' ' ' ARG . 14.0 p -149.75 134.82 10.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 120.826 0.346 . . . . 1.04 111.047 -177.095 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -143.87 121.09 11.53 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.977 -0.379 . . . . 0.54 109.977 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 60.9 m -111.04 137.05 49.15 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.365 0.505 . . . . 1.04 112.365 -174.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.491 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.85 130.18 56.27 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.668 0 N-CA-C 108.392 -0.966 . . . . 1.04 108.392 170.559 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.0 t -92.55 119.7 40.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 O-C-N 121.005 -1.059 . . . . 1.02 108.854 173.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.4 HD12 HD23 ' A' ' 104' ' ' LEU . 2.8 mm? -67.05 -22.82 65.85 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.662 0.615 . . . . 1.01 112.662 -170.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.683 ' OG ' ' HB3' ' A' ' 24' ' ' PRO . 9.7 m -63.87 -18.39 64.12 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.57 0.7 . . . . 1.07 109.482 175.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.1 p -113.72 17.83 17.87 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.164 -0.925 . . . . 1.03 110.034 -177.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.522 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 23.9 mm -113.95 140.82 32.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.896 -0.779 . . . . 1.01 108.896 176.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -102.4 -43.48 5.66 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.897 0.379 . . . . 0.52 110.555 -176.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.468 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 17.2 mtmm -141.81 173.04 11.88 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.086 -0.507 . . . . 1.95 110.988 -177.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.544 HD12 ' CG ' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -151.57 148.63 28.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.621 -0.718 . . . . 1.39 109.148 179.833 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.67 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -133.6 153.22 51.83 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 110.391 -0.226 . . . . 2.02 110.391 -174.872 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.423 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . . . -150.46 140.18 21.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.642 0.258 . . . . 1.05 110.785 176.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.431 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 40.9 p -66.3 118.06 49.52 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.614 -0.721 . . . . 1.05 110.653 -177.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.43 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 12.7 Cg_exo -57.0 159.31 15.03 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.761 2.307 . . . . 0.44 111.897 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.44 -15.92 63.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.195 -0.457 . . . . 1.21 111.316 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.7 m -83.53 -18.57 37.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.232 0.539 . . . . 1.94 110.998 175.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.43 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 73.2 m -79.29 138.31 37.7 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.492 -0.776 . . . . 1.13 111.585 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -62.3 -30.89 71.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.244 -0.889 . . . . 1.77 110.317 174.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -77.35 153.01 34.18 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 114.183 -1.371 . . . . 2.18 111.64 -175.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.433 ' O ' ' HG3' ' A' ' 59' ' ' MET . 1.0 OUTLIER -129.3 98.5 4.9 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.886 -1.052 . . . . 1.11 108.639 172.052 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.474 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.1 OUTLIER -154.64 159.7 40.97 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.351 0.595 . . . . 1.05 111.878 -173.687 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.461 HD11 ' O ' ' A' ' 97' ' ' MET . 1.6 tt -140.96 119.31 12.17 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.69 -1.141 . . . . 1.05 108.416 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.67 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 25.5 mtp180 -103.7 136.68 42.95 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 121.285 0.565 . . . . 3.5 110.863 -179.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.554 ' HB2' ' HB2' ' A' ' 87' ' ' HIS . 1.2 mm? -111.51 104.39 12.8 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.601 -0.727 . . . . 1.03 109.197 176.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.566 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.7 mp -86.53 101.85 11.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.946 -0.39 . . . . 1.11 109.946 -174.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.465 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -61.49 163.97 21.45 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.783 -0.644 . . . . 0.54 112.784 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.522 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 82.0 mttt . . . . . 0 N--CA 1.442 -0.848 0 CA-C-O 121.954 0.883 . . . . 1.08 112.816 -177.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.66 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 1.9 t70 . . . . . 0 CA--C 1.512 -0.509 0 N-CA-C 108.577 -0.897 . . . . 3.23 108.577 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.6 -7.61 3.51 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.881 0.697 . . . . 2.39 112.881 -168.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.421 ' C ' ' H ' ' A' ' 71' ' ' LYS . 82.6 p -64.49 -19.47 65.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.306 0.574 . . . . 3.2 109.567 172.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.66 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.1 ptmt -76.41 40.49 0.22 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.382 -0.826 . . . . 2.95 110.978 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.497 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 19.4 mmtm -44.21 113.48 0.54 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.508 -0.553 . . . . 3.72 109.508 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 50.4 ttt180 -94.97 156.23 16.41 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.733 -0.84 . . . . 4.12 108.733 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -130.36 134.62 47.3 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 121.333 0.587 . . . . 4.59 110.753 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -74.98 174.0 9.92 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.79 -1.096 . . . . 4.41 110.157 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -51.94 -32.05 31.44 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.774 0.657 . . . . 5.69 112.774 -174.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -87.66 7.56 29.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.696 0.284 . . . . 5.38 111.428 -177.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.11 10.96 85.62 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.944 -0.646 . . . . 4.47 112.011 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -72.08 131.62 43.09 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.342 -0.614 . . . . 4.72 109.342 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -70.01 113.18 6.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.988 0.423 . . . . 4.28 110.171 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 3.7 m -126.88 98.68 4.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 108.62 -0.882 . . . . 3.51 108.62 176.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.497 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.6 p -97.17 124.67 48.57 Favored Pre-proline 0 C--N 1.311 -1.08 0 CA-C-N 115.63 -0.714 . . . . 2.87 111.045 -171.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo . . . . . 0 CA--C 1.513 -0.536 0 C-N-CA 123.0 2.467 . . . . 2.06 112.707 -177.962 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.554 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 58.3 m-70 . . . . . 0 C--O 1.216 -0.661 0 N-CA-C 109.677 -0.49 . . . . 0.72 109.677 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.59 ' HB2' ' HG2' ' A' ' 61' ' ' ARG . 14.5 ttm -106.43 120.69 42.55 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 119.768 -0.773 . . . . 1.07 110.738 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 59' ' ' MET . 6.9 m-85 -111.46 130.62 55.66 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.075 -0.966 . . . . 0.27 109.524 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.474 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.15 153.82 27.06 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.358 -0.608 . . . . 1.68 109.358 174.912 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.403 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 17.3 m-85 -131.27 172.93 11.58 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.436 0.636 . . . . 0.32 111.915 -174.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -109.44 -22.48 11.99 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.623 -1.171 . . . . 2.7 110.833 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.403 ' HB2' HG23 ' A' ' 96' ' ' VAL . 48.5 m-80 -144.55 134.88 24.36 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.55 0.691 . . . . 1.16 111.457 -176.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.2 mmm180 -59.32 -40.32 85.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.533 -1.212 . . . . 3.7 112.593 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.455 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 28.8 m -62.21 -34.97 77.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.79 0.329 . . . . 1.13 110.758 -178.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.597 ' O ' HG12 ' A' ' 100' ' ' ILE . 17.3 t -66.17 -57.1 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.415 0 CA-C-N 116.308 -0.406 . . . . 1.06 110.476 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.461 ' O ' HD11 ' A' ' 60' ' ' LEU . 10.4 ptp -58.22 -40.23 81.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.034 -0.53 . . . . 1.02 111.016 -177.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 102' ' ' MET . 26.1 t70 -65.7 -41.38 92.43 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.418 -0.513 . . . . 0.34 110.086 178.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 95' ' ' THR . 1.7 t-20 -68.3 -44.3 75.75 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.178 0.299 . . . . 1.58 111.336 -179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.597 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.6 mm -61.51 -56.95 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 N-CA-C 108.684 -0.858 . . . . 1.01 108.684 178.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.47 ' HE3' ' NE2' ' A' ' 105' ' ' GLN . 30.6 ttpt -50.08 -49.94 49.73 Favored 'General case' 0 C--O 1.217 -0.632 0 O-C-N 124.052 0.845 . . . . 1.47 109.821 176.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.568 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 49.9 ttp -49.26 -53.33 22.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.406 -0.815 . . . . 1.02 111.289 178.014 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.685 ' O ' HG13 ' A' ' 107' ' ' ILE . 20.7 m -61.03 -54.93 38.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.178 -0.464 . . . . 1.04 110.378 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.547 HD12 HD21 ' A' ' 62' ' ' LEU . 23.6 mt -46.72 -53.73 11.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.275 -0.875 . . . . 1.04 110.646 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.544 ' CG ' HD12 ' A' ' 48' ' ' LEU . 93.9 mt-30 -51.97 -43.08 63.4 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.715 -1.129 . . . . 1.96 112.397 177.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 102' ' ' MET . 24.7 mm-40 -70.63 -30.11 66.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.736 0.779 . . . . 3.11 109.897 -178.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.685 HG13 ' O ' ' A' ' 103' ' ' THR . 13.1 mt -75.98 -47.3 32.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 114.582 -1.19 . . . . 1.03 111.028 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.509 HD12 HD11 ' A' ' 48' ' ' LEU . 8.5 mt -58.46 -43.09 86.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.968 -0.56 . . . . 1.04 112.444 -176.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.622 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 16.5 t -67.53 -17.98 64.86 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.933 0.346 . . . . 1.67 111.933 -174.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -61.22 -31.95 71.73 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.499 -0.926 . . . . 1.99 108.499 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.457 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 15.4 m-85 -105.59 12.99 30.6 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.607 -1.179 . . . . 1.0 109.884 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.622 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 5.2 mmpt? . . . . . 0 C--N 1.324 -0.52 0 N-CA-C 108.631 -0.878 . . . . 1.46 108.631 171.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.477 ' CD2' HG23 ' A' ' 103' ' ' THR . 27.2 m80 . . . . . 0 CA--C 1.516 -0.332 0 N-CA-C 110.261 -0.274 . . . . 1.08 110.261 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.1 t -156.03 155.76 33.22 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 119.981 -0.687 . . . . 1.78 112.411 -172.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.465 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -176.07 -163.84 29.32 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 110.523 -1.031 . . . . 0.16 110.523 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.9 130.08 46.05 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 117.308 0.554 . . . . 1.04 110.533 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.46 ' HB3' ' HB3' ' A' ' 89' ' ' PHE . . . -140.26 143.33 35.89 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.955 0.407 . . . . 1.02 111.548 -178.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.49 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 97.3 mt -106.89 109.24 27.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.076 -0.511 . . . . 1.17 110.124 176.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -110.19 137.97 47.2 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.533 -0.914 . . . . 0.43 108.533 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 53.59 25.84 5.21 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 122.705 0.402 . . . . 0.8 111.154 -176.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt 69.52 5.08 4.98 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.521 0.563 . . . . 2.57 112.521 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.411 HG13 ' HZ2' ' A' ' 36' ' ' LYS . 2.2 p -94.28 120.53 43.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 107.809 -1.182 . . . . 1.1 107.809 167.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.439 ' HA ' HG12 ' A' ' 8' ' ' ILE . 78.3 p -73.04 142.83 47.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.291 -0.413 . . . . 1.5 110.762 -175.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -163.07 -163.77 16.53 Favored Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.506 -0.854 . . . . 0.12 112.672 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.9 mm -123.41 133.85 67.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 109.293 -0.632 . . . . 1.02 109.293 -179.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.447 HD11 HD12 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.84 135.2 41.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 110.103 -0.332 . . . . 1.05 110.103 -176.257 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.45 129.99 29.81 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.693 0.282 . . . . 1.04 111.254 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.419 HD13 ' HB ' ' A' ' 103' ' ' THR . 47.6 mt -85.89 132.86 30.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.478 0.656 . . . . 1.04 110.439 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -102.82 104.92 15.23 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.748 -1.115 . . . . 1.98 111.064 -173.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -118.42 170.2 9.12 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.146 -0.687 . . . . 1.2 109.146 176.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.0 t70 79.26 -3.8 2.11 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 122.326 1.06 . . . . 0.58 109.557 -176.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.626 HG21 ' O ' ' A' ' 23' ' ' SER . 30.2 m -102.99 -173.1 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-N 113.832 -1.531 . . . . 1.05 109.427 178.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.626 ' O ' HG21 ' A' ' 22' ' ' VAL . 60.1 p -73.56 169.39 18.59 Favored Pre-proline 0 C--N 1.316 -0.858 0 N-CA-C 105.585 -2.006 . . . . 1.77 105.585 175.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.404 ' O ' HG12 ' A' ' 41' ' ' VAL . 74.5 Cg_exo -40.83 129.42 2.78 Favored 'Trans proline' 0 C--N 1.358 1.073 0 CA-C-N 121.486 1.566 . . . . 0.19 112.628 -143.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.465 ' H ' ' HH ' ' A' ' 111' ' ' TYR . . . -54.22 144.03 21.26 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 114.166 -1.379 . . . . 1.03 112.158 -162.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -125.25 168.83 12.94 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.497 -1.229 . . . . 0.32 111.864 -169.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.505 ' HB3' HG22 ' A' ' 40' ' ' VAL . 2.8 tm? -118.32 106.45 12.78 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 107.592 -1.262 . . . . 1.02 107.592 173.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.1 m -103.31 106.95 17.58 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 120.904 0.383 . . . . 1.02 111.027 -175.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.42 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 85.0 t90 -85.16 131.76 34.39 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.859 -0.793 . . . . 0.17 108.859 172.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.417 ' HG2' HG21 ' A' ' 37' ' ' VAL . 65.1 mtt180 -126.24 159.59 32.61 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.287 -0.634 . . . . 2.24 109.287 174.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.8 p -67.51 176.09 2.53 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.013 -0.736 . . . . 0.63 109.013 177.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.9 p -59.59 -41.75 90.98 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.659 -0.65 . . . . 0.96 111.013 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -82.82 -31.67 28.01 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.272 -0.64 . . . . 2.12 109.272 171.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.48 17.22 22.45 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.161 -0.927 . . . . 0.23 113.595 172.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -65.8 -52.04 54.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.203 0.501 . . . . 1.73 109.928 174.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.411 ' HZ2' HG13 ' A' ' 12' ' ' VAL . 40.8 tttt -77.01 135.93 38.69 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 109.058 -0.719 . . . . 1.91 109.058 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 13.8 p -150.03 135.39 10.75 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 CA-C-O 120.91 0.386 . . . . 1.04 111.137 -175.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -141.96 127.0 18.38 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.458 -0.571 . . . . 0.54 109.458 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.429 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 29.2 m -115.64 131.72 56.85 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.139 0.422 . . . . 1.04 112.139 -172.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.505 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -99.98 129.9 49.94 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 N-CA-C 107.851 -1.166 . . . . 1.04 107.851 168.422 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.43 ' O ' HG12 ' A' ' 45' ' ' ILE . 97.3 t -93.01 121.29 43.59 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 O-C-N 121.148 -0.97 . . . . 1.02 108.577 173.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -68.52 -17.11 64.09 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.564 0.579 . . . . 1.01 112.564 -170.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.53 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 97.7 p -68.5 -19.49 64.54 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.964 -0.754 . . . . 1.07 108.964 174.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.7 p -109.21 15.55 23.12 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.897 -1.047 . . . . 1.03 109.994 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.482 ' HA ' ' HA2' ' A' ' 64' ' ' GLY . 22.2 mm -114.62 141.38 31.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.402 -0.592 . . . . 1.01 109.402 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -102.01 -47.91 4.41 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.799 -0.637 . . . . 0.52 110.648 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 7.8 mtmm -141.86 169.56 17.35 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 120.599 0.238 . . . . 1.95 111.337 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.638 ' CD2' HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -141.26 154.34 45.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.72 -0.845 . . . . 1.39 108.72 175.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.496 ' HG3' HD13 ' A' ' 63' ' ' ILE . 23.5 mt-30 -135.74 145.55 46.74 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 109.365 -0.606 . . . . 2.02 109.365 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.416 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -137.92 134.74 35.34 Favored 'General case' 0 C--N 1.319 -0.746 0 O-C-N 121.726 -0.609 . . . . 1.05 110.672 175.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.536 HG23 ' HB3' ' A' ' 57' ' ' LYS . 68.8 p -59.99 119.08 38.4 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.801 -0.636 . . . . 1.05 110.704 -177.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.499 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 17.4 Cg_exo -57.21 162.19 9.97 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.664 2.242 . . . . 0.44 111.948 177.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.8 -19.6 64.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.084 -0.507 . . . . 1.21 110.899 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 45.7 t -82.59 -18.15 42.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.921 -0.581 . . . . 1.94 110.594 176.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.499 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 48.1 m -76.09 137.8 40.37 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.261 -0.427 . . . . 1.13 111.057 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.54 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 39.8 mt-10 -52.38 -35.38 51.42 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 122.038 0.923 . . . . 1.77 109.987 173.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.54 ' HD2' ' HB2' ' A' ' 56' ' ' GLU . 10.6 mptt -82.09 158.06 23.86 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.112 -1.404 . . . . 2.18 112.984 -169.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.423 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.3 OUTLIER -130.68 96.65 4.15 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.585 -1.189 . . . . 1.11 108.485 169.295 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.512 ' HE1' ' HG2' ' A' ' 57' ' ' LYS . 0.2 OUTLIER -155.16 154.43 32.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.237 0.541 . . . . 1.05 111.55 -173.799 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.449 HD11 ' O ' ' A' ' 97' ' ' MET . 1.6 tt -131.0 120.68 23.84 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.452 -0.944 . . . . 1.05 108.452 177.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.565 ' HG2' ' HB2' ' A' ' 88' ' ' MET . 14.1 mtp180 -104.6 145.11 30.78 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.036 0.446 . . . . 3.5 111.743 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.638 HD13 ' CD2' ' A' ' 48' ' ' LEU . 1.2 mm? -122.43 106.69 11.27 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.31 -0.859 . . . . 1.03 109.587 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.626 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.9 mp -85.19 99.39 7.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 C-N-CA 122.484 0.314 . . . . 1.11 110.211 -174.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.482 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -72.57 145.13 36.65 Favored Glycine 0 C--O 1.221 -0.689 0 C-N-CA 120.971 -0.633 . . . . 0.54 112.587 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.411 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 89.2 mttt . . . . . 0 C--N 1.318 -0.768 0 C-N-CA 122.692 0.397 . . . . 1.08 111.16 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.716 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 26.3 t70 . . . . . 0 C--O 1.218 -0.578 0 N-CA-C 108.469 -0.937 . . . . 3.23 108.469 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -64.84 -4.68 4.69 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.702 0.63 . . . . 2.39 112.702 -169.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.6 p -77.49 -4.04 43.52 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.08 0.467 . . . . 3.2 110.524 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.716 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -85.2 30.39 0.6 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.907 -0.588 . . . . 2.95 110.669 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.426 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 20.0 mtmt -46.82 114.81 0.9 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.262 0.553 . . . . 3.72 110.269 -174.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 55.6 ttt180 -89.11 168.62 12.18 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.611 -0.885 . . . . 4.12 108.611 -169.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.625 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 58.1 mttp -131.13 140.08 49.92 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 118.298 0.499 . . . . 4.59 110.625 174.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.448 ' CG ' ' H ' ' A' ' 75' ' ' ASN . 9.1 t70 -83.61 -173.07 4.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.763 -0.653 . . . . 4.41 110.323 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . 0.448 ' H ' ' CG ' ' A' ' 74' ' ' ASP . 29.7 m-80 -59.56 -31.63 69.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.212 0.53 . . . . 5.69 110.853 -177.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -87.35 1.43 53.34 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.969 -0.56 . . . . 5.38 110.789 -177.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.26 7.74 84.59 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.753 -0.737 . . . . 4.47 111.681 -175.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.625 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 51.1 m-20 -57.4 128.32 36.45 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 110.186 -0.301 . . . . 4.72 110.186 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -73.59 90.12 1.76 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.676 -0.491 . . . . 4.28 109.676 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.429 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 11.1 m -103.24 98.47 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-O 122.026 0.917 . . . . 3.51 109.618 -178.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.463 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.2 p -88.1 119.78 70.47 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-N 115.57 -0.741 . . . . 2.87 109.736 -178.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 31.4 Cg_exo . . . . . 0 CA--C 1.51 -0.712 0 C-N-CA 122.881 2.387 . . . . 2.06 112.588 -173.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 78.0 m-70 . . . . . 0 C--O 1.216 -0.661 0 N-CA-C 107.695 -1.224 . . . . 0.72 107.695 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.565 ' HB2' ' HG2' ' A' ' 61' ' ' ARG . 26.3 ttm -141.87 129.52 21.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 119.183 0.901 . . . . 1.07 111.77 174.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.46 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 4.7 m-85 -118.4 129.38 55.38 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.361 -0.836 . . . . 0.27 109.527 178.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.49 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.03 153.13 27.57 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 121.996 -0.44 . . . . 1.68 110.526 177.217 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.41 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.0 m-85 -133.59 172.53 12.62 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 0.32 111.133 -175.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -119.26 -11.58 9.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.567 -0.742 . . . . 2.7 109.804 177.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.435 ' HB2' HG22 ' A' ' 96' ' ' VAL . 41.5 m-80 -142.66 131.01 22.2 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.212 0.53 . . . . 1.16 110.633 -177.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.459 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.5 mmm180 -64.62 -34.2 77.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.196 -0.911 . . . . 3.7 111.938 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.2 m -62.75 -36.23 82.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.883 0.373 . . . . 1.13 110.824 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.553 ' O ' HG12 ' A' ' 100' ' ' ILE . 10.5 t -67.71 -56.11 14.41 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.399 0 CA-C-N 116.074 -0.512 . . . . 1.06 110.306 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.459 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.8 ptp -58.45 -37.83 76.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.088 -0.505 . . . . 1.02 111.041 -177.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -70.09 -26.25 63.89 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.973 -0.291 . . . . 0.34 111.085 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -85.93 -39.65 16.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.312 -0.403 . . . . 1.58 111.034 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 96' ' ' VAL . 29.0 mm -64.98 -56.44 15.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 108.729 -0.841 . . . . 1.01 108.729 176.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.416 ' HD3' ' HB2' ' A' ' 50' ' ' ALA . 31.0 ttpt -48.31 -47.75 36.41 Favored 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 123.894 0.746 . . . . 1.47 110.161 175.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.711 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 36.2 ttp -50.89 -60.44 3.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.186 -0.915 . . . . 1.02 111.084 178.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.744 ' O ' HG13 ' A' ' 107' ' ' ILE . 86.6 m -55.95 -53.84 52.03 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 123.49 0.494 . . . . 1.04 110.75 -178.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.59 HD11 HD23 ' A' ' 62' ' ' LEU . 25.8 mt -46.54 -58.03 4.17 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.694 0.621 . . . . 1.04 110.261 176.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.469 ' HG3' ' CD1' ' A' ' 48' ' ' LEU . 70.4 mt-30 -52.69 -44.56 66.36 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.303 -0.862 . . . . 1.96 112.511 175.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.711 ' HG3' ' O ' ' A' ' 102' ' ' MET . 48.3 mt-30 -62.07 -30.65 71.13 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.709 0.766 . . . . 3.11 109.659 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.744 HG13 ' O ' ' A' ' 103' ' ' THR . 6.4 mt -81.75 -41.1 18.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 114.688 -1.142 . . . . 1.03 111.297 -177.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 104' ' ' LEU . 5.2 mt -60.27 -42.2 89.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 112.948 0.721 . . . . 1.04 112.948 -174.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.648 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 2.1 p -65.81 -16.35 63.72 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.573 -0.451 . . . . 1.67 112.159 -175.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -63.06 -28.27 69.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.637 0.732 . . . . 1.99 109.096 169.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.53 ' CG ' ' HA ' ' A' ' 43' ' ' SER . 29.0 m-85 -110.41 10.83 23.32 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.95 -1.023 . . . . 1.0 110.309 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.648 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 9.2 mmpt? . . . . . 0 CA--C 1.511 -0.535 0 N-CA-C 108.648 -0.871 . . . . 1.46 108.648 171.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.404 ' CD2' HG23 ' A' ' 103' ' ' THR . 50.8 m80 . . . . . 0 CA--C 1.517 -0.316 0 N-CA-C 110.341 -0.244 . . . . 1.08 110.341 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 43.3 t -157.05 157.6 34.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.544 0.687 . . . . 1.78 112.409 -172.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.52 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.39 -167.16 37.0 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 109.813 -1.315 . . . . 0.16 109.813 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -93.73 135.62 34.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 118.008 0.904 . . . . 1.04 110.583 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.495 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -146.78 142.14 27.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.074 -0.512 . . . . 1.02 111.376 -177.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.763 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.0 mt -98.95 128.25 50.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 110.193 -0.299 . . . . 1.17 110.193 174.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.488 ' HE2' ' ND1' ' A' ' 38' ' ' HIS . 10.7 t80 -135.19 140.48 45.36 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.756 -0.831 . . . . 0.43 108.756 175.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 60.63 24.27 14.04 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.451 0.469 . . . . 0.8 109.87 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt 69.49 -2.75 1.81 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.018 0.927 . . . . 2.57 113.109 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -92.31 123.68 44.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 108.766 -0.828 . . . . 1.1 108.766 170.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.3 m -74.86 145.38 42.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.325 -0.398 . . . . 1.5 110.362 -176.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.01 -158.53 10.15 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 119.869 -1.158 . . . . 0.12 113.497 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.4 mm -125.3 131.5 72.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.456 -0.572 . . . . 1.02 109.456 -177.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.431 HD13 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -101.55 136.15 34.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 110.005 -0.369 . . . . 1.05 110.005 -177.297 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.49 131.31 31.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.608 0.242 . . . . 1.04 111.39 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 54.7 mt -86.21 138.41 19.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 121.211 0.529 . . . . 1.04 110.403 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -109.83 105.23 14.36 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.928 -1.033 . . . . 1.98 111.246 -175.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 36.5 mt-10 -116.99 170.35 8.7 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.902 -0.777 . . . . 1.2 108.902 175.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.422 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 36.3 t70 78.58 -5.01 2.09 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.38 1.086 . . . . 0.58 109.777 -177.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 23' ' ' SER . 31.1 m -102.62 -173.33 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 CA-C-N 113.872 -1.513 . . . . 1.05 109.824 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.636 ' O ' HG22 ' A' ' 22' ' ' VAL . 48.2 m -72.78 167.33 34.56 Favored Pre-proline 0 C--N 1.315 -0.914 0 N-CA-C 105.322 -2.103 . . . . 1.77 105.322 174.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -41.49 127.62 3.28 Favored 'Trans proline' 0 C--N 1.352 0.736 0 CA-C-N 121.13 1.439 . . . . 0.19 112.534 -142.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.428 ' HB1' ' CG2' ' A' ' 107' ' ' ILE . . . -49.64 140.25 11.41 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 113.919 -1.491 . . . . 1.03 112.434 -165.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -125.43 169.48 12.34 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 114.09 -1.414 . . . . 0.32 111.585 -168.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.508 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.1 tm? -118.89 105.64 11.7 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 107.612 -1.255 . . . . 1.02 107.612 173.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 m -100.67 106.48 17.94 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-O 120.973 0.416 . . . . 1.02 110.743 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.3 t90 -85.01 132.02 34.39 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.91 -0.774 . . . . 0.17 108.91 171.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.476 ' HG2' HG23 ' A' ' 37' ' ' VAL . 93.6 mtt180 -126.0 159.74 31.89 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.258 -0.645 . . . . 2.24 109.258 174.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 p -70.71 177.68 3.44 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 110.077 -0.342 . . . . 0.63 110.077 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 p -64.79 -23.19 67.16 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.398 -0.521 . . . . 0.96 111.479 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -99.4 -31.63 11.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.644 0.735 . . . . 2.12 109.054 169.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.418 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 98.49 16.59 31.39 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 114.712 -1.131 . . . . 0.23 112.153 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -67.19 -39.63 86.4 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.263 -0.643 . . . . 1.73 109.263 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.8 tttm -93.68 141.21 28.74 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.412 -0.959 . . . . 1.91 108.412 175.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.476 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.1 p -147.31 136.89 16.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 120.963 0.411 . . . . 1.04 111.007 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.488 ' ND1' ' HE2' ' A' ' 9' ' ' PHE . 3.3 t60 -143.67 118.07 9.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.275 -0.421 . . . . 0.54 109.941 -178.102 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 24.7 m -110.79 133.79 53.05 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.409 0.522 . . . . 1.04 112.409 -173.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.508 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.63 130.24 54.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 N-CA-C 108.103 -1.073 . . . . 1.04 108.103 168.543 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 90.4 t -93.34 120.4 42.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 O-C-N 121.202 -0.936 . . . . 1.02 108.754 173.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -68.14 -19.4 64.81 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.231 0.826 . . . . 1.01 113.231 -169.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.565 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 9.8 p -70.2 -13.45 62.19 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.336 0.589 . . . . 1.07 109.641 175.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.4 p -108.66 11.28 26.63 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.477 -0.783 . . . . 1.03 109.583 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.457 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 26.3 mm -113.83 144.68 20.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.102 -0.703 . . . . 1.01 109.102 178.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -110.77 -41.79 4.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.78 0.324 . . . . 0.52 110.968 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.511 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 14.9 mtmt -140.33 174.39 10.56 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.106 0.479 . . . . 1.95 111.029 -179.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.543 HD13 ' CG ' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -152.49 134.73 15.04 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.673 -0.862 . . . . 1.39 108.673 -178.106 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -133.45 115.19 14.5 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 122.268 -0.27 . . . . 2.02 111.289 -170.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -114.8 146.67 40.77 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.179 -0.326 . . . . 1.05 111.802 -175.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.413 ' CG2' ' HB2' ' A' ' 59' ' ' MET . 80.5 p -72.44 120.91 83.15 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 115.922 -0.581 . . . . 1.05 110.921 -176.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.618 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 10.0 Cg_exo -62.3 165.96 13.98 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.832 2.355 . . . . 0.44 111.921 175.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.89 -27.25 67.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.042 -0.526 . . . . 1.21 111.313 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.5 m -84.91 -4.84 59.28 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.87 -0.605 . . . . 1.94 110.772 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.618 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 35.2 m -82.64 148.53 27.91 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.03 -0.532 . . . . 1.13 111.635 178.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -70.52 7.04 1.17 Allowed 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.169 -0.923 . . . . 1.77 111.909 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.497 ' H ' ' C ' ' A' ' 55' ' ' SER . 40.7 mmtm -130.26 153.3 48.76 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 115.171 -0.922 . . . . 2.18 111.204 -167.265 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.487 ' O ' ' HG3' ' A' ' 59' ' ' MET . 80.1 mmm -125.61 97.23 5.08 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.565 -0.902 . . . . 1.11 108.565 167.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.487 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.1 OUTLIER -155.28 156.32 35.33 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.242 0.544 . . . . 1.05 111.983 -172.538 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.523 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.3 tt -135.17 118.88 17.11 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.435 -0.95 . . . . 1.05 108.435 177.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.718 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.2 mtp180 -101.85 144.6 30.3 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.342 0.591 . . . . 3.5 111.748 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.532 HD23 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -120.24 110.19 16.29 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.776 -1.102 . . . . 1.03 108.863 178.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.518 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.4 mp -88.88 100.91 11.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.135 0.493 . . . . 1.11 110.475 -172.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.22 141.02 31.91 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.652 -0.704 . . . . 0.54 112.615 -177.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.457 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 79.7 mttt . . . . . 0 C--N 1.318 -0.763 0 N-CA-C 112.992 0.738 . . . . 1.08 112.992 -174.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 5.3 m-20 . . . . . 0 C--O 1.215 -0.751 0 N-CA-C 108.687 -0.856 . . . . 3.23 108.687 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.436 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 43.1 mt-10 -65.02 -2.58 2.8 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.606 0.241 . . . . 2.39 111.618 -175.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . 0.461 ' C ' ' H ' ' A' ' 71' ' ' LYS . 12.9 p -69.6 -13.26 62.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.388 0.613 . . . . 3.2 109.761 169.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.541 ' NZ ' ' HG2' ' A' ' 82' ' ' PRO . 13.6 ptmm? -75.34 29.69 0.1 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.164 -0.926 . . . . 2.95 110.797 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.461 ' H ' ' C ' ' A' ' 69' ' ' SER . 20.0 mtmt -48.09 114.66 0.97 Allowed 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.369 0.604 . . . . 3.72 109.835 -174.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.521 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 79.3 ttt180 -92.91 165.65 12.78 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 114.976 -1.011 . . . . 4.12 108.838 -171.333 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.421 ' HD3' ' O ' ' A' ' 77' ' ' GLY . 54.9 mttp -127.11 139.34 53.05 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.302 0.572 . . . . 4.59 109.919 171.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.467 ' CG ' ' H ' ' A' ' 75' ' ' ASN . 13.7 t70 -91.79 -165.33 1.33 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.175 -0.92 . . . . 4.41 110.368 -174.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . 0.467 ' H ' ' CG ' ' A' ' 74' ' ' ASP . 78.9 m-20 -62.71 -33.17 74.56 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.375 0.509 . . . . 5.69 112.375 -169.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -84.28 1.62 43.97 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 111.67 0.248 . . . . 5.38 111.67 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.421 ' O ' ' HD3' ' A' ' 73' ' ' LYS . . . 79.72 4.33 89.34 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.55 -0.833 . . . . 4.47 111.422 -175.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -72.01 140.49 49.09 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.921 -0.4 . . . . 4.72 109.921 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -68.98 116.87 9.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.105 -0.498 . . . . 4.28 110.879 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.521 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 9.8 m -122.47 98.85 6.13 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 108.877 -0.786 . . . . 3.51 108.877 173.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 1.2 p -86.31 109.94 27.34 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-O 121.235 0.541 . . . . 2.87 110.126 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.541 ' HG2' ' NZ ' ' A' ' 70' ' ' LYS . 52.5 Cg_exo . . . . . 0 CA--C 1.513 -0.547 0 C-N-CA 123.549 2.833 . . . . 2.06 112.279 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.522 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 67.1 m-70 . . . . . 0 C--O 1.219 -0.527 0 N-CA-C 106.954 -1.499 . . . . 0.72 106.954 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.718 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 15.6 ttm -140.09 125.98 19.54 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 119.403 1.001 . . . . 1.07 111.814 175.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 59' ' ' MET . 15.8 m-85 -108.12 158.07 17.74 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.965 -1.016 . . . . 0.27 108.72 176.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.763 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -106.69 157.6 17.59 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 108.806 -0.812 . . . . 1.68 108.806 175.455 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.523 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 30.9 m-85 -139.39 170.46 15.88 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.011 0.434 . . . . 0.32 111.615 -176.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -123.86 -5.78 7.98 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.593 -0.731 . . . . 2.7 110.379 176.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -147.13 126.15 12.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.041 -0.527 . . . . 1.16 109.918 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.599 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 13.8 mmm180 -61.52 -35.4 77.62 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 116.011 -0.541 . . . . 3.7 110.994 177.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -56.85 -36.2 69.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.186 -0.461 . . . . 1.13 110.423 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.619 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.6 t -69.18 -60.26 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.022 -0.536 . . . . 1.06 110.329 176.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.599 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.5 ptp -57.93 -40.14 79.71 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 116.578 -0.283 . . . . 1.02 110.813 -176.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.477 ' N ' ' HG3' ' A' ' 97' ' ' MET . 35.2 t70 -58.92 -44.44 91.31 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.477 -0.489 . . . . 0.34 110.381 176.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -72.24 -42.4 65.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.303 -0.408 . . . . 1.58 111.927 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.619 HG12 ' O ' ' A' ' 96' ' ' VAL . 27.3 mm -61.94 -56.94 14.49 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 N-CA-C 108.833 -0.802 . . . . 1.01 108.833 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.42 ' HE3' ' NE2' ' A' ' 105' ' ' GLN . 31.7 ttpt -49.43 -52.69 27.22 Favored 'General case' 0 C--O 1.216 -0.683 0 O-C-N 123.934 0.771 . . . . 1.47 109.762 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.551 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 39.1 ttp -48.17 -53.28 17.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.121 -0.945 . . . . 1.02 111.474 178.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.722 ' O ' HG13 ' A' ' 107' ' ' ILE . 85.6 m -60.64 -54.51 44.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.134 -0.484 . . . . 1.04 110.483 178.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 24.9 mt -47.9 -54.54 12.33 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.782 0.676 . . . . 1.04 110.63 177.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.543 ' CG ' HD13 ' A' ' 48' ' ' LEU . 94.1 mt-30 -49.02 -49.0 43.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.391 -1.277 . . . . 1.96 111.923 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 102' ' ' MET . 27.6 mm-40 -67.77 -28.38 67.56 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.451 0.643 . . . . 3.11 110.556 -177.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.722 HG13 ' O ' ' A' ' 103' ' ' THR . 8.2 mt -75.87 -41.18 39.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-N 115.128 -0.942 . . . . 1.03 110.642 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 104' ' ' LEU . 7.5 mt -65.16 -40.58 89.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.387 -0.369 . . . . 1.04 111.614 -178.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.2 p -61.02 -18.91 60.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.838 0.351 . . . . 1.67 111.517 -177.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -66.58 -48.71 68.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.311 0.577 . . . . 1.99 109.443 173.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.565 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 15.4 m-85 -77.48 -22.68 50.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.316 -0.857 . . . . 1.0 109.859 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 115.019 -0.991 . . . . 1.46 109.911 177.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.487 ' CD2' HG21 ' A' ' 103' ' ' THR . 41.7 m80 . . . . . 0 CA--C 1.511 -0.546 0 N-CA-C 109.704 -0.48 . . . . 1.08 109.704 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.8 p -158.29 164.68 36.18 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 119.749 -0.78 . . . . 1.78 112.648 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.423 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 176.76 -163.75 32.91 Favored Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 114.692 -1.14 . . . . 0.16 110.916 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.83 135.72 43.97 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.677 -0.49 . . . . 1.04 109.677 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.471 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -148.54 143.01 26.36 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.039 0.447 . . . . 1.02 111.756 -175.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.455 HG12 ' HA ' ' A' ' 13' ' ' SER . 89.1 mt -106.63 124.21 62.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.22 -0.446 . . . . 1.17 110.226 177.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -127.35 140.75 51.98 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 108.682 -0.858 . . . . 0.43 108.682 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 54.36 25.62 6.16 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.636 0.375 . . . . 0.8 111.113 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm 65.49 14.44 9.47 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.801 0.667 . . . . 2.57 112.801 -177.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.435 HG11 ' CH2' ' A' ' 29' ' ' TRP . 2.1 p -103.97 121.72 55.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 108.428 -0.953 . . . . 1.1 108.428 166.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.455 ' HA ' HG12 ' A' ' 8' ' ' ILE . 50.1 p -75.49 144.38 42.05 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.379 -0.373 . . . . 1.5 110.85 -175.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.421 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.96 -160.01 10.64 Favored Glycine 0 N--CA 1.437 -1.243 0 C-N-CA 120.256 -0.973 . . . . 0.12 113.527 -177.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.7 mm -126.12 132.19 70.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 109.296 -0.631 . . . . 1.02 109.296 -177.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.441 HD11 HD12 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.37 136.39 34.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 120.684 0.278 . . . . 1.05 110.477 -175.664 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.24 127.26 25.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.92 0.391 . . . . 1.04 111.76 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.475 HD12 ' HA ' ' A' ' 3' ' ' HIS . 57.8 mt -86.11 135.51 24.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.757 -0.461 . . . . 1.04 109.757 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -110.32 106.72 16.2 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.164 -0.471 . . . . 1.98 110.989 -175.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 30.4 mt-10 -117.35 170.25 8.86 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.848 -0.797 . . . . 1.2 108.848 174.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.425 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 34.6 t70 78.04 -3.98 2.28 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 122.342 1.068 . . . . 0.58 109.737 -176.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 23' ' ' SER . 32.9 m -103.09 -174.07 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-N 113.96 -1.473 . . . . 1.05 109.651 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.589 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.8 m -72.35 164.66 57.78 Favored Pre-proline 0 C--N 1.316 -0.868 0 N-CA-C 104.997 -2.223 . . . . 1.77 104.997 174.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -41.45 128.79 3.46 Favored 'Trans proline' 0 C--N 1.353 0.785 0 CA-C-N 120.949 1.374 . . . . 0.19 112.744 -141.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.41 ' HB2' HG23 ' A' ' 107' ' ' ILE . . . -47.66 141.3 5.46 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 113.919 -1.491 . . . . 1.03 112.703 -165.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -127.71 164.7 21.54 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 114.382 -1.281 . . . . 0.32 111.731 -169.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.49 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.2 tm? -115.48 105.44 12.81 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 107.55 -1.278 . . . . 1.02 107.55 173.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.0 m -100.39 106.71 18.33 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 120.941 0.4 . . . . 1.02 110.57 -176.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.435 ' CH2' HG11 ' A' ' 12' ' ' VAL . 82.7 t90 -84.67 131.72 34.55 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.801 -0.815 . . . . 0.17 108.801 172.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.506 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 36.8 mtm180 -122.66 160.86 24.93 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.824 -0.806 . . . . 2.24 108.824 175.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -72.38 178.1 4.18 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.995 -0.743 . . . . 0.63 108.995 175.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.421 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 5.1 p -60.43 -31.25 70.23 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.307 -0.557 . . . . 0.96 111.046 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -94.6 -24.27 17.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.785 0.802 . . . . 2.12 109.686 172.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.506 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 88.32 16.76 58.48 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 114.762 -1.108 . . . . 0.23 111.591 -178.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -65.69 -41.43 92.39 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.052 -0.722 . . . . 1.73 109.052 175.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.6 tttt -91.98 140.86 29.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.03 -0.987 . . . . 1.91 108.361 171.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.437 HG21 ' HG2' ' A' ' 30' ' ' ARG . 11.1 p -148.48 135.96 13.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.812 0.339 . . . . 1.04 110.639 -178.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -143.65 124.99 14.65 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.966 -0.383 . . . . 0.54 109.966 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.3 m -110.81 141.14 44.55 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.144 0.424 . . . . 1.04 112.144 -173.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -111.09 129.22 66.76 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 N-CA-C 108.037 -1.097 . . . . 1.04 108.037 168.163 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.447 ' O ' HG12 ' A' ' 45' ' ' ILE . 94.3 t -93.01 121.41 43.68 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 O-C-N 120.991 -1.068 . . . . 1.02 108.973 173.347 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.431 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.8 mm? -68.75 -21.22 64.38 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.098 0.777 . . . . 1.01 113.098 -169.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 p -68.23 -15.98 63.79 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.383 0.611 . . . . 1.07 109.386 175.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.471 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 5.1 p -111.18 14.29 21.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.395 -0.82 . . . . 1.03 110.079 -178.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.496 HG23 ' CD1' ' A' ' 62' ' ' LEU . 25.3 mm -112.41 139.05 39.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.961 -0.755 . . . . 1.01 108.961 177.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -105.23 -43.84 4.91 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.181 -0.463 . . . . 0.52 110.586 -175.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.452 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 26.7 mtpt -133.07 169.09 17.34 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 121.334 0.588 . . . . 1.95 111.292 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.494 ' CD1' HD13 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -150.77 146.34 26.33 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.909 -1.041 . . . . 1.39 108.998 176.57 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.667 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 11.6 mm-40 -134.5 145.23 48.59 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.979 -0.378 . . . . 2.02 109.979 -173.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.502 ' HB1' ' HD3' ' A' ' 101' ' ' LYS . . . -142.12 132.69 25.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 118.135 0.425 . . . . 1.05 111.032 174.136 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.471 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 82.6 p -64.98 118.03 45.03 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.508 -0.769 . . . . 1.05 110.704 -176.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -54.86 160.23 7.99 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 123.057 2.505 . . . . 0.44 112.34 177.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.03 -12.87 61.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.06 -0.518 . . . . 1.21 111.438 -178.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.9 m -89.16 -19.23 25.73 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.219 0.533 . . . . 1.94 110.558 174.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.9 m -72.57 141.3 48.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.553 -0.749 . . . . 1.13 111.005 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.5 -6.42 19.55 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.408 -0.815 . . . . 1.77 111.151 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.474 ' HG2' ' HE2' ' A' ' 59' ' ' MET . 9.0 mptt -107.65 159.81 16.18 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.957 -1.02 . . . . 2.18 111.716 -175.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.471 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 3.1 mtp -131.91 98.3 4.41 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 114.636 -1.165 . . . . 1.11 108.778 168.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.474 ' HE2' ' HG2' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -154.89 155.36 34.19 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.727 -0.67 . . . . 1.05 112.15 -172.364 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.454 ' HA ' ' O ' ' A' ' 49' ' ' GLN . 1.4 tt -135.11 119.05 17.36 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.659 -1.155 . . . . 1.05 108.302 177.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.676 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 6.4 mtp180 -104.25 138.04 41.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.232 0.539 . . . . 3.5 111.171 -178.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.548 ' HB2' ' HB2' ' A' ' 87' ' ' HIS . 1.6 mm? -115.9 106.02 13.34 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.34 -0.845 . . . . 1.03 109.252 176.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.536 ' N ' HD13 ' A' ' 63' ' ' ILE . 3.0 mp -88.67 108.33 18.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 110.318 -0.253 . . . . 1.11 110.318 -173.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.58 157.82 40.81 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.135 -0.555 . . . . 0.54 112.659 179.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.471 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 82.8 mttt . . . . . 0 C--N 1.321 -0.672 0 CA-C-O 121.018 0.437 . . . . 1.08 111.184 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.436 ' HB2' ' HD2' ' A' ' 70' ' ' LYS . 23.8 m-20 . . . . . 0 N--CA 1.445 -0.717 0 N-CA-C 108.156 -1.053 . . . . 3.23 108.156 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -70.26 -2.84 14.56 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.249 0.547 . . . . 2.39 111.044 -174.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.3 p -91.37 -3.72 56.46 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.621 -0.718 . . . . 3.2 110.601 173.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 8.5 ptmm? -83.19 27.89 0.55 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.206 -0.452 . . . . 2.95 110.459 -177.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.53 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 29.3 mmtm -44.86 113.38 0.55 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.542 -0.754 . . . . 3.72 110.94 -170.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.418 ' HB3' HG22 ' A' ' 80' ' ' VAL . 72.3 ttt180 -98.04 165.93 11.67 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 108.174 -1.047 . . . . 4.12 108.174 178.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 63.1 mttp -134.01 140.83 46.96 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.704 -0.48 . . . . 4.59 109.704 172.57 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.487 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.5 OUTLIER -79.09 -172.07 2.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.642 -0.708 . . . . 4.41 110.057 -178.237 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . 0.408 ' N ' HD21 ' A' ' 75' ' ' ASN . 0.9 OUTLIER -62.15 -31.84 72.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.616 0.246 . . . . 5.69 111.327 -179.109 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.487 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 26.0 mt-10 -78.79 -31.53 46.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.701 0.286 . . . . 5.38 110.798 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 114.65 17.09 7.16 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.786 -0.721 . . . . 4.47 112.635 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.579 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 38.1 m-80 -74.07 134.05 42.92 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.571 -0.529 . . . . 4.72 109.571 177.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -72.01 91.41 1.22 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.568 -0.53 . . . . 4.28 109.568 178.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.418 HG22 ' HB3' ' A' ' 72' ' ' ARG . 27.2 m -93.25 100.76 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.902 0 CA-C-O 122.035 0.922 . . . . 3.51 109.885 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.53 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.5 p -94.82 106.27 23.75 Favored Pre-proline 0 C--N 1.319 -0.73 0 CA-C-N 115.554 -0.748 . . . . 2.87 109.612 177.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 36.6 Cg_exo . . . . . 0 C--O 1.233 0.23 0 C-N-CA 123.366 2.711 . . . . 2.06 113.212 -171.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 52.9 m-70 . . . . . 0 C--O 1.218 -0.562 0 N-CA-C 108.974 -0.75 . . . . 0.72 108.974 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.676 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 24.1 ttm -108.27 118.97 38.16 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 119.898 -0.721 . . . . 1.07 111.341 -177.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.471 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.3 m-85 -109.53 128.54 55.27 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.2 -0.909 . . . . 0.27 109.905 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.6 OUTLIER -81.59 151.09 27.83 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 110.038 -0.356 . . . . 1.68 110.038 176.058 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -130.54 174.43 9.9 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.362 0.601 . . . . 0.32 111.69 -173.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -115.42 -19.54 10.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.103 -0.953 . . . . 2.7 110.878 177.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -142.61 133.56 25.71 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.423 0.63 . . . . 1.16 110.926 -178.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.461 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.7 mmm180 -61.46 -35.52 77.86 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.713 -1.131 . . . . 3.7 112.063 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.9 m -62.85 -34.14 76.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.735 0.302 . . . . 1.13 110.775 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.535 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.0 t -69.2 -57.06 9.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.299 -0.41 . . . . 1.06 110.328 178.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.461 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 12.6 ptp -57.96 -38.69 76.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.056 -0.52 . . . . 1.02 111.39 -176.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.63 -37.46 82.49 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.996 -0.282 . . . . 0.34 110.297 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.4 ' HA ' ' HE3' ' A' ' 102' ' ' MET . 4.2 m-80 -72.56 -43.03 64.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.242 -0.435 . . . . 1.58 111.163 178.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.551 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 32.4 mm -62.42 -56.62 16.41 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 N-CA-C 108.849 -0.797 . . . . 1.01 108.849 177.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.502 ' HD3' ' HB1' ' A' ' 50' ' ' ALA . 12.3 ttpp -51.34 -46.24 62.6 Favored 'General case' 0 C--O 1.22 -0.481 0 O-C-N 123.693 0.621 . . . . 1.47 110.112 177.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.637 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 38.2 ttp -50.3 -59.69 3.72 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.669 -0.696 . . . . 1.02 111.175 177.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.77 ' O ' HG13 ' A' ' 107' ' ' ILE . 35.5 m -57.39 -52.81 63.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.212 -0.449 . . . . 1.04 110.546 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 26.4 mt -45.8 -55.35 6.7 Favored 'General case' 0 C--O 1.223 -0.336 0 O-C-N 123.685 0.615 . . . . 1.04 110.313 174.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -55.75 -43.93 77.13 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.877 -1.056 . . . . 1.96 112.484 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.637 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.4 mt-30 -62.12 -32.43 73.0 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.877 0.846 . . . . 3.11 108.862 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.77 HG13 ' O ' ' A' ' 103' ' ' THR . 9.8 mt -78.63 -46.68 24.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 114.284 -1.325 . . . . 1.03 111.116 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 104' ' ' LEU . 7.9 mt -61.8 -39.52 83.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.074 -0.512 . . . . 1.04 111.675 -177.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.0 t -60.17 -26.82 66.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.653 0.263 . . . . 1.67 111.065 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -65.64 -43.82 88.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.537 0.684 . . . . 1.99 109.249 174.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -91.53 12.04 22.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 1.0 109.759 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? . . . . . 0 C--N 1.321 -0.641 0 CA-C-N 114.75 -1.113 . . . . 1.46 108.118 173.467 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.537 ' CD2' HG21 ' A' ' 103' ' ' THR . 75.3 m80 . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 111.656 0.243 . . . . 1.08 111.656 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 p -158.68 165.86 33.39 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.085 -0.646 . . . . 1.78 112.171 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.481 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 175.57 -165.77 36.78 Favored Glycine 0 N--CA 1.44 -1.081 0 CA-C-N 114.971 -1.013 . . . . 0.16 110.915 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.3 134.1 46.13 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 117.153 0.476 . . . . 1.04 110.009 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -146.56 148.61 32.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.623 -0.262 . . . . 1.02 111.656 -176.071 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.773 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 61.6 mt -109.39 122.83 64.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.952 0.406 . . . . 1.17 110.719 176.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.408 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.3 t80 -125.59 134.16 52.02 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.785 -0.82 . . . . 0.43 108.785 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 59.52 26.61 15.62 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.777 0.431 . . . . 0.8 110.543 -177.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt 69.56 1.06 3.19 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.825 0.85 . . . . 2.57 113.125 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.408 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.5 OUTLIER -92.45 123.77 44.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 108.418 -0.956 . . . . 1.1 108.418 167.842 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.3 m -75.9 145.77 40.24 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.901 0.381 . . . . 1.5 110.234 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.6 -160.82 11.17 Favored Glycine 0 N--CA 1.437 -1.297 0 C-N-CA 120.317 -0.944 . . . . 0.12 112.944 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.5 mm -125.28 135.04 65.29 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.217 -0.661 . . . . 1.02 109.217 -178.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.449 HD13 HD13 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -104.08 135.5 41.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 110.133 -0.321 . . . . 1.05 110.133 -175.493 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.69 129.2 30.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.928 0.394 . . . . 1.04 111.594 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.501 HD13 ' HA ' ' A' ' 3' ' ' HIS . 58.5 mt -86.11 134.98 26.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 109.812 -0.44 . . . . 1.04 109.812 177.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -111.33 103.57 11.97 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.245 -0.434 . . . . 1.98 111.303 -173.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 30.9 mt-10 -114.95 170.32 8.43 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.435 -0.95 . . . . 1.2 108.435 173.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.1 t70 80.77 -5.84 1.69 Allowed 'General case' 0 N--CA 1.484 1.225 0 CA-C-O 122.393 1.092 . . . . 0.58 109.472 -176.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 23' ' ' SER . 26.4 m -102.74 -173.18 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-N 113.732 -1.576 . . . . 1.05 109.107 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.618 ' O ' HG22 ' A' ' 22' ' ' VAL . 30.5 m -72.15 168.12 25.95 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 105.549 -2.019 . . . . 1.77 105.549 175.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.401 ' O ' HG12 ' A' ' 41' ' ' VAL . 68.8 Cg_exo -40.76 128.36 2.64 Favored 'Trans proline' 0 C--N 1.359 1.095 0 CA-C-N 121.288 1.496 . . . . 0.19 112.518 -145.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.411 ' HB2' ' CG2' ' A' ' 107' ' ' ILE . . . -49.24 140.39 9.9 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 114.215 -1.357 . . . . 1.03 112.534 -164.042 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.29 166.47 15.84 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.353 -1.294 . . . . 0.32 111.862 -170.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.504 ' HB3' HG23 ' A' ' 40' ' ' VAL . 3.2 tm? -115.84 107.3 14.85 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 107.633 -1.247 . . . . 1.02 107.633 173.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.1 m -104.16 106.94 17.62 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 120.82 0.343 . . . . 1.02 111.301 -174.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.41 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 86.2 t90 -85.21 130.44 34.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.942 -0.762 . . . . 0.17 108.942 172.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HG2' HG21 ' A' ' 37' ' ' VAL . 61.4 mtt180 -125.16 156.7 37.98 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 108.77 -0.826 . . . . 2.24 108.77 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -66.0 174.47 2.47 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.301 -0.629 . . . . 0.63 109.301 178.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.1 p -58.02 -36.92 73.38 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.408 -0.517 . . . . 0.96 110.681 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -87.67 -32.26 19.32 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.558 0.694 . . . . 2.12 109.716 172.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.29 12.78 37.93 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 114.922 -1.036 . . . . 0.23 112.825 176.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -66.68 -36.53 82.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.36 0.6 . . . . 1.73 109.895 176.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -95.68 137.82 34.2 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.414 -0.958 . . . . 1.91 108.414 174.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.444 HG21 ' HG2' ' A' ' 30' ' ' ARG . 14.6 p -150.48 136.31 11.54 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-O 120.994 0.426 . . . . 1.04 111.391 -177.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -143.71 128.8 18.64 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.634 -0.506 . . . . 0.54 109.634 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.408 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 30.4 m -114.37 140.86 48.31 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.033 0.383 . . . . 1.04 112.033 -172.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.504 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -107.89 128.97 62.77 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 N-CA-C 108.18 -1.044 . . . . 1.04 108.18 168.383 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.436 ' O ' HG12 ' A' ' 45' ' ' ILE . 99.8 t -92.3 118.78 38.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 121.228 -0.92 . . . . 1.02 108.963 173.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.421 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.8 mm? -67.56 -18.55 65.05 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.866 0.691 . . . . 1.01 112.866 -170.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.512 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 80.4 p -68.18 -18.3 64.56 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.177 -0.675 . . . . 1.07 109.177 176.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.9 p -109.99 13.21 23.45 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.886 -1.052 . . . . 1.03 110.206 -177.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.546 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 27.4 mm -111.63 140.47 30.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.054 -0.521 . . . . 1.01 109.657 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -106.86 -43.99 4.54 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.882 -0.599 . . . . 0.52 110.839 -175.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.518 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 40.4 mtpt -133.57 172.26 12.98 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.411 0.624 . . . . 1.95 111.537 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.495 ' CD2' ' HB3' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -151.08 148.95 28.94 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.939 -1.028 . . . . 1.39 108.882 174.8 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.502 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 5.4 mm-40 -136.34 153.36 51.16 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.381 -0.6 . . . . 2.02 109.381 -176.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.449 ' HB2' ' SD ' ' A' ' 97' ' ' MET . . . -145.66 140.36 27.24 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 118.278 0.49 . . . . 1.05 110.917 176.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 76.2 p -71.08 118.21 63.56 Favored Pre-proline 0 C--O 1.234 0.258 0 CA-C-N 116.134 -0.485 . . . . 1.05 111.272 -176.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.483 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 17.4 Cg_exo -56.82 160.69 11.62 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.867 2.378 . . . . 0.44 112.299 177.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.56 -20.88 66.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.697 -0.683 . . . . 1.21 111.871 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.8 m -85.9 -18.07 33.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.203 0.525 . . . . 1.94 111.067 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.483 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 35.1 m -68.93 143.34 54.48 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.527 -0.76 . . . . 1.13 112.263 -177.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -58.18 -26.76 63.15 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 114.639 -1.164 . . . . 1.77 110.975 171.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.433 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 68.1 mmtt -91.73 153.05 19.89 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.948 -1.478 . . . . 2.18 111.984 -169.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.602 ' O ' ' HG3' ' A' ' 59' ' ' MET . 80.0 mmm -127.16 96.16 4.51 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.317 -0.994 . . . . 1.11 108.317 167.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.602 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -158.52 158.34 33.83 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.581 0.705 . . . . 1.05 112.226 -173.326 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.473 HD12 ' O ' ' A' ' 97' ' ' MET . 2.4 tt -135.43 120.62 18.91 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.662 -1.154 . . . . 1.05 108.121 176.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.606 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 1.0 OUTLIER -102.94 146.34 28.47 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.307 0.575 . . . . 3.5 111.591 -177.697 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.513 HD22 HD12 ' A' ' 104' ' ' LEU . 1.2 mm? -125.62 106.18 9.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.847 -1.07 . . . . 1.03 108.952 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.518 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.4 mp -87.73 105.85 15.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-O 120.695 0.283 . . . . 1.11 110.532 -172.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.89 147.66 36.93 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.306 -0.474 . . . . 0.54 113.062 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.546 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 90.1 mttt . . . . . 0 C--N 1.323 -0.583 0 C-N-CA 122.922 0.489 . . . . 1.08 111.945 -178.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.624 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 4.7 m-20 . . . . . 0 C--O 1.221 -0.415 0 N-CA-C 108.835 -0.802 . . . . 3.23 108.835 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.69 -6.34 7.65 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.328 0.492 . . . . 2.39 112.328 -172.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.0 p -69.39 -8.45 46.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.387 0.613 . . . . 3.2 110.106 172.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.2 ptpt -82.92 33.21 0.43 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.489 -0.778 . . . . 2.95 111.226 178.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.1 mtmm -46.63 114.21 0.78 Allowed 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.277 -0.638 . . . . 3.72 109.277 -177.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.502 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.8 ttt180 -96.65 161.55 13.84 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.012 -0.994 . . . . 4.12 109.005 -168.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 98.8 mttt -129.23 146.56 51.11 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 109.669 -0.493 . . . . 4.59 109.669 173.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.48 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 1.1 p-10 -81.48 -168.85 2.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.993 -0.549 . . . . 4.41 110.52 -177.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -59.37 -32.04 69.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.665 -0.243 . . . . 5.69 111.629 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.48 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 16.5 mt-10 -82.67 -41.51 19.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.093 0.473 . . . . 5.38 110.648 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 127.12 16.0 2.45 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.737 -0.744 . . . . 4.47 112.145 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.558 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 37.1 m-80 -73.11 138.18 45.65 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.63 -0.507 . . . . 4.72 109.63 178.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -75.14 93.32 2.77 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.203 -0.453 . . . . 4.28 110.401 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.502 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 14.7 m -103.91 99.45 8.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.466 0.65 . . . . 3.51 109.309 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.0 p -92.41 111.84 52.49 Favored Pre-proline 0 C--N 1.316 -0.889 0 CA-C-O 121.366 0.603 . . . . 2.87 110.655 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.418 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 39.1 Cg_exo . . . . . 0 N--CA 1.46 -0.472 0 C-N-CA 123.114 2.543 . . . . 2.06 112.082 -178.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 75.1 m-70 . . . . . 0 C--O 1.22 -0.496 0 N-CA-C 107.217 -1.401 . . . . 0.72 107.217 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.606 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 26.6 ttm -141.94 131.84 24.41 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 119.033 0.833 . . . . 1.07 111.204 175.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.492 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.5 m-85 -120.97 134.64 55.3 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.471 -0.786 . . . . 0.27 109.529 178.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.773 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -79.99 159.39 26.27 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.507 -0.553 . . . . 1.68 109.507 178.071 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.423 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 16.7 m-85 -138.4 175.16 9.81 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.349 0.595 . . . . 0.32 112.151 -177.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.1 p-10 -116.94 -20.55 9.34 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.111 -0.95 . . . . 2.7 110.843 178.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -145.87 143.77 29.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.91 0.385 . . . . 1.16 110.451 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.523 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.2 OUTLIER -73.84 -28.56 61.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.831 -0.622 . . . . 3.7 111.835 -176.739 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.3 m -63.9 -38.53 91.41 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.757 0.313 . . . . 1.13 110.823 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.516 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.2 t -63.55 -56.85 14.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.324 -0.398 . . . . 1.06 110.273 178.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.523 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 15.7 ptp -58.58 -39.54 80.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.834 -0.621 . . . . 1.02 111.21 -176.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.7 -41.0 98.9 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 120.675 -0.41 . . . . 0.34 110.331 177.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -71.17 -39.29 71.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.271 -0.422 . . . . 1.58 111.71 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.543 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 34.2 mm -64.99 -56.2 16.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 108.858 -0.793 . . . . 1.01 108.858 175.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.543 ' HE3' ' NE2' ' A' ' 105' ' ' GLN . 31.8 ttpt -51.57 -45.62 63.16 Favored 'General case' 0 C--O 1.223 -0.293 0 O-C-N 123.911 0.757 . . . . 1.47 110.232 177.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.476 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 41.3 ttp -51.87 -54.18 32.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.28 -0.873 . . . . 1.02 111.099 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.715 ' O ' HG13 ' A' ' 107' ' ' ILE . 24.4 m -62.33 -52.16 64.76 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.179 -0.464 . . . . 1.04 110.395 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 27.0 mt -46.97 -54.5 10.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.737 -0.665 . . . . 1.04 110.522 175.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.543 ' NE2' ' HE3' ' A' ' 101' ' ' LYS . 43.8 mt-30 -52.59 -46.39 66.92 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.826 -1.079 . . . . 1.96 112.239 176.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 102' ' ' MET . 13.7 mm100 -64.14 -27.93 69.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.671 0.748 . . . . 3.11 110.287 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 103' ' ' THR . 7.2 mt -81.08 -41.05 18.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 114.737 -1.119 . . . . 1.03 110.798 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 104' ' ' LEU . 6.3 mt -67.29 -38.63 81.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.354 -0.385 . . . . 1.04 111.84 -178.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.2 p -59.97 -24.92 64.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.014 0.435 . . . . 1.67 111.202 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 -62.25 -52.31 64.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.608 0.718 . . . . 1.99 109.55 172.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.512 ' CG ' ' HA ' ' A' ' 43' ' ' SER . 21.5 m-85 -85.7 18.37 2.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.02 -0.991 . . . . 1.0 110.472 177.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? . . . . . 0 C--N 1.318 -0.766 0 N-CA-C 107.842 -1.17 . . . . 1.46 107.842 171.831 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.567 ' CD2' HG23 ' A' ' 103' ' ' THR . 56.2 m80 . . . . . 0 CA--C 1.511 -0.528 0 N-CA-C 109.624 -0.51 . . . . 1.08 109.624 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.9 p -157.71 168.54 26.93 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.604 -0.839 . . . . 1.78 112.785 -176.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.42 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 173.54 -163.43 34.74 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 110.116 -1.194 . . . . 0.16 110.116 -178.339 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -100.29 135.66 41.38 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 117.513 0.657 . . . . 1.04 110.167 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -145.43 152.27 39.56 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.42 -0.355 . . . . 1.02 110.859 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.0 mt -111.7 122.21 65.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.446 -0.343 . . . . 1.17 110.465 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.489 ' O ' HG11 ' A' ' 12' ' ' VAL . 32.4 t80 -126.17 132.6 51.78 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.218 -0.66 . . . . 0.43 109.218 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 58.98 28.16 17.3 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.037 0.535 . . . . 0.8 110.328 -176.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt 69.34 0.77 3.01 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.015 0.746 . . . . 2.57 113.015 178.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.489 HG11 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -91.45 121.69 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 108.047 -1.094 . . . . 1.1 108.047 167.077 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.7 m -75.61 145.22 41.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.095 -0.502 . . . . 1.5 110.21 -177.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.443 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.33 -156.81 8.46 Favored Glycine 0 N--CA 1.436 -1.363 0 C-N-CA 120.078 -1.058 . . . . 0.12 113.482 -177.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 15.8 mm -125.44 132.31 71.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 C-N-CA 123.217 0.607 . . . . 1.02 109.429 -177.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.428 HD13 HD12 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.73 135.96 38.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.704 -0.48 . . . . 1.05 109.704 -177.483 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.87 130.87 32.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.808 0.337 . . . . 1.04 111.264 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.509 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 52.8 mt -86.16 138.12 19.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 109.685 -0.487 . . . . 1.04 109.685 177.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -111.22 103.16 11.55 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.137 -0.483 . . . . 1.98 111.091 -174.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.409 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 31.1 mt-10 -115.94 170.36 8.54 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.163 -0.68 . . . . 1.2 109.163 175.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.409 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 26.5 t70 77.26 -3.28 2.49 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.37 1.081 . . . . 0.58 109.583 -178.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 23' ' ' SER . 32.8 m -103.0 -173.92 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.046 0 CA-C-N 113.885 -1.507 . . . . 1.05 109.798 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.615 ' O ' HG22 ' A' ' 22' ' ' VAL . 53.6 m -73.01 166.52 42.72 Favored Pre-proline 0 C--N 1.315 -0.896 0 N-CA-C 105.211 -2.144 . . . . 1.77 105.211 173.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -41.34 128.52 3.26 Favored 'Trans proline' 0 C--N 1.355 0.902 0 CA-C-N 121.037 1.406 . . . . 0.19 112.738 -141.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.422 ' HB1' HG21 ' A' ' 107' ' ' ILE . . . -50.21 142.18 10.26 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 114.105 -1.407 . . . . 1.03 112.593 -165.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -127.74 169.4 13.89 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 114.447 -1.251 . . . . 0.32 111.985 -168.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.487 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.3 tm? -120.46 107.25 12.66 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 107.939 -1.134 . . . . 1.02 107.939 174.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.8 m -101.42 108.53 20.16 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 116.427 -0.351 . . . . 1.02 111.193 -175.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -85.3 131.13 34.46 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.853 -0.795 . . . . 0.17 108.853 170.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.496 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 89.1 mtt180 -122.26 151.12 41.41 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.628 -0.878 . . . . 2.24 108.628 172.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.649 ' OG ' ' HB3' ' A' ' 36' ' ' LYS . 2.8 m -61.99 172.49 1.36 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.16 -0.311 . . . . 0.63 110.16 173.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.443 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.1 p -60.02 -36.13 76.58 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.218 -0.593 . . . . 0.96 110.62 178.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -86.17 -14.68 43.33 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.397 -0.594 . . . . 2.12 109.397 175.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.496 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 76.99 19.51 77.35 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.147 -0.933 . . . . 0.23 112.513 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -84.37 -35.43 23.19 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.533 -0.914 . . . . 1.73 108.533 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.649 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 43.7 tttp -90.68 141.09 29.15 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.18 -1.373 . . . . 1.91 108.59 172.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.444 HG22 ' HG2' ' A' ' 30' ' ' ARG . 9.5 p -150.28 138.56 14.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 C-N-CA 120.834 -0.346 . . . . 1.04 111.066 -176.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -145.07 125.02 13.48 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.973 -0.38 . . . . 0.54 109.973 175.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 31.7 m -110.67 137.11 48.76 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.104 0.409 . . . . 1.04 112.104 -174.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.487 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.37 129.53 56.58 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 N-CA-C 108.117 -1.068 . . . . 1.04 108.117 168.636 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.9 t -93.15 121.66 44.02 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 O-C-N 121.23 -0.919 . . . . 1.02 108.926 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.447 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.6 mm? -68.71 -18.56 64.27 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.104 0.779 . . . . 1.01 113.104 -169.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.7 p -72.0 -11.93 61.0 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.066 -0.654 . . . . 1.07 109.75 175.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.2 p -111.31 13.07 21.66 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.345 -0.843 . . . . 1.03 109.624 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.459 HG22 ' CD1' ' A' ' 62' ' ' LEU . 26.8 mm -113.75 138.04 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-N 115.712 -0.676 . . . . 1.01 109.25 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -101.75 -42.56 6.13 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.094 -0.503 . . . . 0.52 110.456 -177.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.0 mtmm -142.17 172.7 12.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.306 -0.407 . . . . 1.95 111.012 -176.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.468 ' CD2' ' HB3' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -151.01 149.04 29.09 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.591 -0.892 . . . . 1.39 108.591 179.739 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.455 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 16.5 mm-40 -138.64 127.76 24.09 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 110.453 -0.203 . . . . 2.02 110.453 -175.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.5 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . . . -122.01 134.85 54.8 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.452 -0.78 . . . . 1.05 110.968 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.458 ' HB ' ' OG ' ' A' ' 55' ' ' SER . 69.1 p -63.37 115.39 17.71 Favored Pre-proline 0 C--O 1.234 0.247 0 CA-C-N 115.913 -0.585 . . . . 1.05 110.409 -175.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -54.98 158.95 10.31 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.953 2.436 . . . . 0.44 112.046 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.94 -11.76 49.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.273 -0.421 . . . . 1.21 111.382 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.0 t -109.4 25.9 11.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.24 0.543 . . . . 1.94 110.358 176.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.458 ' OG ' ' HB ' ' A' ' 51' ' ' THR . 83.9 p -99.98 158.83 15.54 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.746 -0.464 . . . . 1.13 109.746 176.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -82.84 12.68 4.55 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 121.298 0.571 . . . . 1.77 110.516 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.504 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 42.9 mmtm -130.6 162.97 28.16 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.539 -0.755 . . . . 2.18 111.271 -171.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.463 ' O ' ' HG3' ' A' ' 59' ' ' MET . 3.5 mtp -136.9 97.95 3.65 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.997 -1.001 . . . . 1.11 108.826 167.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.504 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -156.81 155.13 31.01 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.556 -0.747 . . . . 1.05 111.41 -171.557 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.443 HD13 ' O ' ' A' ' 97' ' ' MET . 1.6 tt -131.94 119.03 20.57 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.383 -0.969 . . . . 1.05 108.383 176.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.6 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 6.9 mtp180 -102.82 146.04 28.87 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 121.423 0.63 . . . . 3.5 111.325 -179.011 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.536 HD23 HD12 ' A' ' 104' ' ' LEU . 1.3 mm? -125.63 104.72 8.53 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 114.524 -1.216 . . . . 1.03 108.787 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.547 ' N ' HD13 ' A' ' 63' ' ' ILE . 2.0 mp -85.66 102.3 11.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.724 0.297 . . . . 1.11 110.315 -172.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -63.94 152.96 48.18 Favored Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 115.854 -0.612 . . . . 0.54 112.455 178.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 76.8 mttt . . . . . 0 C--N 1.317 -0.804 0 CA-C-O 121.436 0.636 . . . . 1.08 112.509 -175.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.526 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 34.4 m-20 . . . . . 0 C--O 1.216 -0.671 0 N-CA-C 108.359 -0.978 . . . . 3.23 108.359 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 82' ' ' PRO . 46.2 mt-10 -64.86 -1.18 1.82 Allowed 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 112.651 0.611 . . . . 2.39 112.651 -171.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.3 p -72.75 -9.18 58.35 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.401 0.62 . . . . 3.2 109.94 168.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.625 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 11.6 ptmm? -80.03 41.79 0.53 Allowed 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.261 -0.882 . . . . 2.95 111.051 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.419 ' HE2' ' OE1' ' A' ' 79' ' ' GLU . 18.9 mttp -43.41 117.39 1.11 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.562 -0.744 . . . . 3.72 111.411 -175.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.559 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 25.7 ttt180 -101.47 158.87 15.75 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.15 -0.932 . . . . 4.12 109.118 -175.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 94.1 mttt -131.54 146.67 52.33 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.361 -0.607 . . . . 4.59 109.361 171.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.472 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER -76.62 -174.33 2.92 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.194 -0.457 . . . . 4.41 110.229 -178.902 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -56.65 -32.94 65.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 111.801 0.297 . . . . 5.69 111.801 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.472 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 21.5 mt-10 -81.02 -46.52 14.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.833 0.349 . . . . 5.38 110.823 -178.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.01 13.66 1.17 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.669 -0.776 . . . . 4.47 112.494 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.403 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 37.8 m-80 -71.1 129.01 37.85 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.402 -0.592 . . . . 4.72 109.402 177.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.419 ' OE1' ' HE2' ' A' ' 71' ' ' LYS . 35.4 tt0 -70.05 101.85 1.91 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.099 0.476 . . . . 4.28 110.083 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.559 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 10.1 m -113.88 98.76 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 CA-C-O 121.818 0.818 . . . . 3.51 109.017 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.441 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.5 OUTLIER -87.74 112.64 50.09 Favored Pre-proline 0 C--N 1.311 -1.104 0 CA-C-N 115.762 -0.653 . . . . 2.87 110.035 -177.846 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.471 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 31.7 Cg_exo . . . . . 0 CA--C 1.511 -0.628 0 C-N-CA 123.152 2.568 . . . . 2.06 112.636 -176.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.6 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 75.2 m-70 . . . . . 0 C--O 1.215 -0.743 0 N-CA-C 107.022 -1.473 . . . . 0.72 107.022 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.584 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 25.2 ttm -139.99 124.96 18.51 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 119.056 0.844 . . . . 1.07 111.047 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.414 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.6 m-85 -113.95 128.72 56.52 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.166 -0.925 . . . . 0.27 109.443 178.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.6 OUTLIER -80.99 151.59 28.38 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.92 -0.4 . . . . 1.68 109.92 176.771 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -132.75 173.37 11.43 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.057 0.455 . . . . 0.32 110.809 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -124.9 -6.29 7.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.5 -0.773 . . . . 2.7 109.424 172.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -136.55 120.4 17.45 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.953 -0.567 . . . . 1.16 110.882 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.454 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.0 mmm180 -64.0 -35.58 81.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.344 -0.844 . . . . 3.7 111.872 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.2 m -63.17 -36.62 84.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.448 -0.342 . . . . 1.13 110.883 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.582 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.5 t -67.1 -57.19 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 CA-C-N 116.47 -0.332 . . . . 1.06 110.203 178.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.454 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 12.9 ptp -56.59 -37.84 71.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 1.02 111.363 -175.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.55 -43.18 85.78 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.602 -0.439 . . . . 0.34 110.765 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -69.5 -41.49 76.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.447 -0.342 . . . . 1.58 111.471 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.1 mm -62.45 -57.41 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 108.685 -0.857 . . . . 1.01 108.685 176.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.5 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 23.4 ttpp -50.12 -49.56 51.4 Favored 'General case' 0 C--O 1.218 -0.583 0 O-C-N 123.902 0.751 . . . . 1.47 110.164 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.688 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 37.4 ttp -48.76 -59.8 3.25 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 123.961 0.788 . . . . 1.02 111.391 177.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.779 ' O ' HG13 ' A' ' 107' ' ' ILE . 36.0 m -57.76 -50.46 73.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.304 -0.407 . . . . 1.04 110.335 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 35.3 mt -46.81 -55.77 7.38 Favored 'General case' 0 C--O 1.221 -0.404 0 O-C-N 123.744 0.652 . . . . 1.04 110.278 174.052 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.455 ' HG2' ' CD1' ' A' ' 48' ' ' LEU . 51.2 mt-30 -54.52 -44.95 73.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.913 -1.04 . . . . 1.96 112.134 177.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 102' ' ' MET . 22.6 mt-30 -61.82 -31.51 71.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.847 0.832 . . . . 3.11 108.956 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.779 HG13 ' O ' ' A' ' 103' ' ' THR . 8.6 mt -80.99 -43.75 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 114.584 -1.189 . . . . 1.03 111.163 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.553 HG13 ' O ' ' A' ' 104' ' ' LEU . 9.0 mt -63.95 -37.52 80.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.164 -0.471 . . . . 1.04 111.638 -177.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.6 t -55.4 -30.92 61.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.283 -0.417 . . . . 1.67 110.782 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -62.47 -41.61 98.89 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.264 0.554 . . . . 1.99 109.732 176.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -97.73 18.73 15.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.701 -0.682 . . . . 1.0 109.963 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.68 0 N-CA-C 107.926 -1.138 . . . . 1.46 107.926 176.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.406 ' HA ' HD11 ' A' ' 18' ' ' ILE . 76.0 m80 . . . . . 0 N--CA 1.473 0.691 0 N-CA-C 112.664 0.616 . . . . 1.08 112.664 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.4 p -149.03 171.89 15.64 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.214 -0.594 . . . . 1.78 112.592 -170.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.485 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 169.77 -160.31 33.32 Favored Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 115.041 -0.981 . . . . 0.16 110.744 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.36 132.01 52.9 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 117.423 0.612 . . . . 1.04 110.315 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.528 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -143.82 147.43 34.1 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.566 -0.288 . . . . 1.02 111.709 -176.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.768 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 64.6 mt -104.44 133.59 48.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.874 0.369 . . . . 1.17 110.178 175.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -132.85 129.14 38.07 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 108.534 -0.913 . . . . 0.43 108.534 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 56.75 34.27 24.35 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.559 0.344 . . . . 0.8 110.977 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm 69.72 -3.98 1.54 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.27 0.841 . . . . 2.57 113.27 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.2 p -92.2 118.03 36.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 108.664 -0.865 . . . . 1.1 108.664 170.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -75.06 145.79 42.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.02 -0.536 . . . . 1.5 110.337 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -160.71 -160.99 11.07 Favored Glycine 0 N--CA 1.439 -1.161 0 C-N-CA 120.149 -1.024 . . . . 0.12 113.244 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -124.66 132.38 71.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 109.281 -0.637 . . . . 1.02 109.281 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.44 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.49 135.39 41.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 110.221 -0.288 . . . . 1.05 110.221 -175.327 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.6 130.42 27.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.625 -0.261 . . . . 1.04 111.499 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.448 HD13 ' HB ' ' A' ' 103' ' ' THR . 43.3 mt -85.55 137.48 20.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.384 0.611 . . . . 1.04 110.449 176.34 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -106.76 106.23 16.65 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.999 -1.0 . . . . 1.98 110.791 -176.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -118.86 169.05 10.2 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.502 -0.555 . . . . 1.2 109.502 175.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.7 t70 76.25 -0.73 3.05 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 122.381 1.086 . . . . 0.58 109.601 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.62 HG21 ' O ' ' A' ' 23' ' ' SER . 33.9 m -103.55 -171.65 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 113.7 -1.591 . . . . 1.05 109.869 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.62 ' O ' HG21 ' A' ' 22' ' ' VAL . 54.9 p -71.94 168.34 23.61 Favored Pre-proline 0 C--N 1.318 -0.775 0 N-CA-C 105.259 -2.126 . . . . 1.77 105.259 175.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -42.73 128.29 4.94 Favored 'Trans proline' 0 C--N 1.355 0.92 0 CA-C-N 121.524 1.58 . . . . 0.19 112.059 -145.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.45 ' HB2' ' CG2' ' A' ' 107' ' ' ILE . . . -52.85 142.86 18.05 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-N 114.093 -1.412 . . . . 1.03 112.245 -162.039 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -127.47 168.48 14.84 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 114.534 -1.212 . . . . 0.32 112.133 -168.195 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.512 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.1 tm? -118.16 106.77 13.18 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.649 -1.241 . . . . 1.02 107.649 173.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.448 HG22 ' OG1' ' A' ' 39' ' ' THR . 6.9 m -102.96 107.2 17.92 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 120.998 0.428 . . . . 1.02 111.23 -176.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -85.02 131.39 34.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.716 -0.846 . . . . 0.17 108.716 171.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.419 ' HG2' HG22 ' A' ' 37' ' ' VAL . 60.8 mtt85 -126.43 158.83 34.98 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.918 -0.771 . . . . 2.24 108.918 174.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.0 p -68.15 176.33 2.76 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.669 -0.493 . . . . 0.63 109.669 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.5 p -58.78 -35.96 73.65 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 120.524 -0.471 . . . . 0.96 111.538 -179.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -93.77 -28.74 15.74 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.301 -0.629 . . . . 2.12 109.301 172.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.2 17.41 22.52 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.313 -0.858 . . . . 0.23 113.198 174.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -66.12 -48.26 71.44 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.865 -0.42 . . . . 1.73 109.865 173.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.0 tttt -82.89 138.05 34.02 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.925 -0.768 . . . . 1.91 108.925 174.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.419 HG22 ' HG2' ' A' ' 30' ' ' ARG . 14.5 p -149.25 135.64 12.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.009 0.433 . . . . 1.04 111.157 -177.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -144.58 128.92 17.86 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.881 -0.415 . . . . 0.54 109.881 178.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 47.0 m -117.86 137.96 52.43 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.343 0.497 . . . . 1.04 112.343 -172.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.512 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.68 130.7 55.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 N-CA-C 108.329 -0.989 . . . . 1.04 108.329 169.242 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 94.5 t -93.13 120.43 42.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 O-C-N 121.305 -0.872 . . . . 1.02 108.702 172.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.46 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -67.83 -18.86 64.97 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.875 0.695 . . . . 1.01 112.875 -170.119 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 15.5 t -69.78 -13.57 62.35 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.327 -0.549 . . . . 1.07 109.84 174.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.2 p -108.99 6.81 25.5 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.934 -0.575 . . . . 1.03 109.844 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.519 HG21 ' CD1' ' A' ' 62' ' ' LEU . 32.2 mm -109.27 138.37 36.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.671 -0.695 . . . . 1.01 109.792 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -102.58 -45.91 4.9 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.805 -0.634 . . . . 0.52 110.631 -178.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.534 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 23.5 mtpp -133.21 173.77 11.09 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.368 0.604 . . . . 1.95 111.861 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 47' ' ' LYS . 0.2 OUTLIER -153.38 142.09 20.98 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.809 -1.087 . . . . 1.39 108.657 178.009 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.476 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 15.1 mm-40 -136.53 127.16 27.06 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 110.348 -0.241 . . . . 2.02 110.348 -174.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.454 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . . . -121.92 135.2 54.86 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 121.548 -0.72 . . . . 1.05 111.583 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.459 HG21 ' CB ' ' A' ' 57' ' ' LYS . 80.0 p -64.9 119.03 54.71 Favored Pre-proline 0 N--CA 1.467 0.403 0 CA-C-N 115.909 -0.587 . . . . 1.05 110.949 -176.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.485 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 23.7 Cg_exo -55.56 159.36 11.15 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.859 2.372 . . . . 0.44 112.006 178.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.67 -14.89 63.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.91 -0.586 . . . . 1.21 110.721 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.58 -7.68 43.38 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.474 -0.785 . . . . 1.94 110.386 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.516 ' C ' ' H ' ' A' ' 57' ' ' LYS . 42.4 m -83.88 147.35 27.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.938 -0.574 . . . . 1.13 111.805 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -70.46 11.94 0.3 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.479 -0.782 . . . . 1.77 111.851 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.539 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 25.8 mmtp -127.03 157.96 38.21 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.58 -0.737 . . . . 2.18 111.41 -171.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.559 ' O ' ' HG3' ' A' ' 59' ' ' MET . 70.8 mmm -130.94 96.36 4.04 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.017 -1.105 . . . . 1.11 108.017 165.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.559 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -156.15 152.51 28.0 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.52 0.676 . . . . 1.05 111.891 -172.181 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.491 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.5 tt -131.67 119.62 21.63 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.665 -1.152 . . . . 1.05 108.453 178.094 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.476 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 7.6 mtp180 -102.24 144.24 31.01 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 121.122 0.487 . . . . 3.5 111.154 -178.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.532 HD21 HD11 ' A' ' 104' ' ' LEU . 1.3 mm? -122.88 111.81 17.1 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.167 -0.924 . . . . 1.03 109.228 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.548 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.8 mp -87.98 107.76 17.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 122.462 0.305 . . . . 1.11 110.93 -171.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.96 143.75 35.37 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.216 -0.516 . . . . 0.54 112.241 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.431 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.1 mttt . . . . . 0 C--N 1.321 -0.658 0 N-CA-C 113.221 0.823 . . . . 1.08 113.221 -174.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.613 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 24.1 m-20 . . . . . 0 N--CA 1.447 -0.62 0 N-CA-C 108.103 -1.073 . . . . 3.23 108.103 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.25 -3.8 1.49 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.22 0.822 . . . . 2.39 113.22 -169.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.1 p -71.46 -12.2 61.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.134 0.492 . . . . 3.2 109.959 171.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.613 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 21.1 ptmt -76.4 42.91 0.29 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.693 0.797 . . . . 2.95 110.772 176.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -45.33 115.67 0.97 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.689 -0.687 . . . . 3.72 110.827 -174.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.586 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 79.6 ttt180 -94.65 163.55 13.33 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.605 -0.725 . . . . 4.12 109.39 -172.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 93.7 mttt -130.74 146.19 52.14 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.882 -0.414 . . . . 4.59 109.882 173.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -88.82 -165.66 1.39 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.477 -0.783 . . . . 4.41 110.781 -173.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -66.13 -16.56 64.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.337 0.495 . . . . 5.69 112.337 -176.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.568 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 22.6 mt-10 -107.02 -8.0 16.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.866 0.365 . . . . 5.38 111.088 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.72 14.32 47.2 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.529 -0.844 . . . . 4.47 112.21 -178.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.568 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 50.0 m-80 -71.28 138.9 49.74 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.899 -0.778 . . . . 4.72 108.899 176.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -76.0 100.55 4.93 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.123 0.487 . . . . 4.28 109.811 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.586 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 11.0 m -114.24 106.27 20.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.292 0.567 . . . . 3.51 109.797 -177.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.452 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 t -80.19 128.13 74.3 Favored Pre-proline 0 C--N 1.316 -0.871 0 C-N-CA 120.307 -0.557 . . . . 2.87 110.497 -175.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 25.4 Cg_exo . . . . . 0 CA--C 1.513 -0.563 0 C-N-CA 123.254 2.636 . . . . 2.06 112.099 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.506 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 87.3 m-70 . . . . . 0 C--O 1.223 -0.32 0 N-CA-C 107.964 -1.124 . . . . 0.72 107.964 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.406 ' HG3' ' HG2' ' A' ' 61' ' ' ARG . 28.0 ttm -141.22 135.47 30.76 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 118.627 0.649 . . . . 1.07 110.611 174.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 59' ' ' MET . 11.3 m-85 -126.34 134.74 51.0 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.044 -0.526 . . . . 0.27 109.724 174.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.768 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -80.83 158.47 25.38 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.32 -0.622 . . . . 1.68 109.32 176.65 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.491 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.7 m-85 -140.16 171.25 14.43 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.896 0.379 . . . . 0.32 110.99 -178.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -121.94 -15.04 7.93 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.12 -0.491 . . . . 2.7 110.288 175.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -135.86 122.16 20.48 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.238 0.542 . . . . 1.16 110.68 -177.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.499 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.8 mmm180 -59.86 -34.8 73.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.098 -0.956 . . . . 3.7 112.276 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.424 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 19.2 m -61.96 -32.67 73.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.854 0.359 . . . . 1.13 110.567 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.622 ' O ' HG12 ' A' ' 100' ' ' ILE . 18.8 t -69.92 -58.8 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 CA-C-N 116.249 -0.432 . . . . 1.06 110.363 179.047 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.541 ' HE3' ' CE ' ' A' ' 58' ' ' MET . 11.6 ptp -55.84 -37.76 69.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.088 -0.505 . . . . 1.02 111.261 -176.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.435 ' N ' ' HG3' ' A' ' 97' ' ' MET . 37.4 t70 -64.65 -48.23 75.57 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.628 -0.429 . . . . 0.34 110.096 176.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 95' ' ' THR . 7.9 t-20 -63.42 -41.68 98.7 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.608 0.763 . . . . 1.58 111.409 -179.274 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.9 mm -63.97 -58.51 7.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 109.278 -0.638 . . . . 1.01 109.278 178.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.454 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 23.5 ttpp -51.44 -47.86 62.92 Favored 'General case' 0 C--O 1.215 -0.729 0 O-C-N 123.785 0.678 . . . . 1.47 110.02 177.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.491 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.9 ttp -48.65 -54.38 14.93 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.238 -0.892 . . . . 1.02 111.255 176.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.726 ' O ' HG13 ' A' ' 107' ' ' ILE . 28.1 m -60.69 -55.2 36.11 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.835 -0.621 . . . . 1.04 110.205 178.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 30.7 mt -45.8 -55.03 7.09 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.391 -0.822 . . . . 1.04 110.613 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.402 ' HG2' ' CD1' ' A' ' 48' ' ' LEU . 49.8 mt-30 -53.36 -45.02 69.01 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.519 -1.219 . . . . 1.96 112.454 178.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 102' ' ' MET . 75.5 mm-40 -64.87 -34.96 79.63 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.674 0.75 . . . . 3.11 109.85 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.726 HG13 ' O ' ' A' ' 103' ' ' THR . 8.9 mt -71.45 -45.49 68.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.604 -1.18 . . . . 1.03 110.879 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.511 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.1 mt -63.09 -40.48 89.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.135 -0.484 . . . . 1.04 111.331 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 t -58.18 -26.5 62.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.196 -0.456 . . . . 1.67 111.068 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -63.41 -49.11 75.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.062 0.458 . . . . 1.99 109.883 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.424 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 34.2 m-85 -79.75 -12.16 59.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.619 -0.718 . . . . 1.0 110.013 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.321 -0.632 0 CA-C-N 115.102 -0.954 . . . . 1.46 108.819 174.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.466 ' HB3' ' HB ' ' A' ' 18' ' ' ILE . 75.6 m80 . . . . . 0 CA--C 1.515 -0.393 0 N-CA-C 110.448 -0.205 . . . . 1.08 110.448 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.8 t -152.17 155.02 36.99 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.891 -0.724 . . . . 1.78 112.626 -168.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.531 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . -174.44 -164.31 29.15 Favored Glycine 0 N--CA 1.437 -1.245 0 CA-C-N 114.341 -1.3 . . . . 0.16 110.554 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.98 135.05 39.54 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 117.558 0.679 . . . . 1.04 110.906 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.469 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -148.76 153.26 37.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.389 -0.369 . . . . 1.02 111.647 -178.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.743 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.9 mt -112.25 128.29 68.96 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 CA-C-O 120.686 0.279 . . . . 1.17 110.461 177.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -126.97 133.53 50.56 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 108.897 -0.779 . . . . 0.43 108.897 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 58.85 27.77 16.58 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.758 0.423 . . . . 0.8 110.857 -178.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt 70.5 0.06 3.1 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.218 0.607 . . . . 2.57 112.555 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.3 p -92.7 122.46 44.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 108.545 -0.909 . . . . 1.1 108.545 167.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.9 p -81.71 145.98 30.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.224 -0.444 . . . . 1.5 111.072 -173.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.434 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -162.68 -154.92 7.8 Favored Glycine 0 N--CA 1.439 -1.103 0 C-N-CA 120.375 -0.917 . . . . 0.12 113.461 -177.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.9 mm -126.71 130.5 71.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 109.334 -0.617 . . . . 1.02 109.334 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.447 HD12 HD13 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -100.8 137.07 29.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 110.101 -0.333 . . . . 1.05 110.101 -175.857 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.83 129.8 28.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.701 0.286 . . . . 1.04 111.573 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.466 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 41.3 mt -85.5 139.02 18.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.237 0.542 . . . . 1.04 109.81 174.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 25' ' ' ALA . 17.4 t30 -110.33 103.26 11.9 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.973 -1.012 . . . . 1.98 111.301 -174.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.443 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 31.1 mt-10 -114.61 169.76 8.82 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.863 -0.791 . . . . 1.2 108.863 174.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.443 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 38.0 t70 79.49 -5.59 1.91 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 122.446 1.117 . . . . 0.58 109.776 -176.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.635 HG21 ' O ' ' A' ' 23' ' ' SER . 22.8 m -103.23 -172.73 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.05 0 CA-C-N 113.767 -1.561 . . . . 1.05 109.406 178.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.635 ' O ' HG21 ' A' ' 22' ' ' VAL . 59.3 p -72.41 167.92 28.31 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 105.199 -2.149 . . . . 1.77 105.199 175.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -41.66 127.04 3.35 Favored 'Trans proline' 0 C--N 1.355 0.892 0 CA-C-N 121.317 1.506 . . . . 0.19 112.729 -143.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.441 ' HA ' ' O ' ' A' ' 19' ' ' ASN . . . -43.38 136.8 2.98 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 113.841 -1.527 . . . . 1.03 112.895 -168.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.68 169.07 12.33 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 114.092 -1.413 . . . . 0.32 111.679 -169.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 39' ' ' THR . 3.2 tm? -119.57 105.38 11.16 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 107.807 -1.183 . . . . 1.02 107.807 174.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.7 m -104.58 106.89 17.56 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-O 121.155 0.502 . . . . 1.02 111.245 -176.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -84.63 128.61 34.69 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.965 -0.754 . . . . 0.17 108.965 172.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.439 ' HG2' HG23 ' A' ' 37' ' ' VAL . 96.1 mtt180 -120.48 158.11 27.94 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.455 -0.943 . . . . 2.24 108.455 172.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 p -70.18 176.09 4.12 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.275 -0.639 . . . . 0.63 109.275 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.434 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 4.2 p -57.32 -36.25 70.88 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.524 . . . . 0.96 111.004 -179.022 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -91.82 -30.92 15.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.569 0.699 . . . . 2.12 109.759 172.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.5 15.5 32.0 Favored Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.152 -0.931 . . . . 0.23 112.769 175.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.92 -42.06 95.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.334 -0.617 . . . . 1.73 109.334 175.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -91.27 139.41 30.76 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.815 -0.809 . . . . 1.91 108.815 173.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.439 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.9 p -149.61 137.72 14.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 120.79 0.328 . . . . 1.04 110.967 -179.071 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -144.51 129.04 18.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.634 -0.257 . . . . 0.54 110.351 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.489 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 53.3 m -112.52 143.59 43.42 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.216 0.451 . . . . 1.04 112.216 -174.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.483 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -113.6 129.89 68.62 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.722 0 N-CA-C 107.923 -1.14 . . . . 1.04 107.923 167.847 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 67.2 t -92.32 121.04 42.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 O-C-N 121.024 -1.047 . . . . 1.02 108.914 173.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.407 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -68.91 -18.38 64.1 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 113.011 0.745 . . . . 1.01 113.011 -169.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 p -69.02 -16.76 63.79 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.574 0.702 . . . . 1.07 109.382 175.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.407 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 4.7 p -109.06 16.62 22.43 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.977 -1.011 . . . . 1.03 110.088 -178.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.42 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 31.2 mm -112.25 138.38 41.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.759 -0.46 . . . . 1.01 109.759 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -102.07 -40.22 6.94 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.013 -0.54 . . . . 0.52 110.657 -176.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.444 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 12.4 mtmm -144.96 174.46 11.0 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.872 0.367 . . . . 1.95 111.26 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.5 HD13 ' CG ' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -151.34 133.63 15.32 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.632 -0.877 . . . . 1.39 108.632 177.079 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.498 ' HG3' HD13 ' A' ' 63' ' ' ILE . 9.2 mt-30 -130.01 127.2 39.5 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 110.285 -0.265 . . . . 2.02 110.285 -176.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -118.06 141.47 48.44 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 121.914 -0.492 . . . . 1.05 111.039 178.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.407 HG21 ' HB3' ' A' ' 57' ' ' LYS . 53.0 p -62.29 121.24 65.24 Favored Pre-proline 0 C--N 1.332 -0.175 0 CA-C-N 115.912 -0.585 . . . . 1.05 110.633 -178.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.439 ' O ' ' HB2' ' A' ' 55' ' ' SER . 24.0 Cg_exo -53.96 163.58 3.04 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.66 2.24 . . . . 0.44 112.465 178.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.73 79.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.146 -0.479 . . . . 1.21 110.598 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.0 m -76.11 -13.73 60.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.569 -0.741 . . . . 1.94 111.035 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.439 ' HB2' ' O ' ' A' ' 52' ' ' PRO . 46.1 m -75.1 135.3 41.18 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 121.697 0.761 . . . . 1.13 111.391 179.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -59.46 -26.77 65.51 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.009 -1.45 . . . . 1.77 110.756 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.407 ' HB3' HG21 ' A' ' 51' ' ' THR . 37.0 mmtt -82.74 146.74 28.84 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 114.399 -1.273 . . . . 2.18 111.493 -177.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.591 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.4 OUTLIER -123.07 96.63 5.09 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.032 -0.986 . . . . 1.11 108.564 170.021 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.591 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -156.31 152.31 27.5 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 121.585 0.707 . . . . 1.05 112.069 -173.543 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.55 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.4 tt -129.83 118.89 22.47 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.553 -1.203 . . . . 1.05 108.143 177.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 15.0 mtm180 -101.83 133.47 46.54 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.229 0.538 . . . . 3.5 110.886 -178.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.525 HD22 HD11 ' A' ' 104' ' ' LEU . 1.3 mm? -111.84 107.26 16.24 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 115.099 -0.955 . . . . 1.03 109.205 176.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.69 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.4 mp -85.31 97.81 5.88 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 109.368 -0.604 . . . . 1.11 109.368 -172.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.31 134.48 15.72 Favored Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 115.941 -0.572 . . . . 0.54 112.46 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.42 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 96.1 mttt . . . . . 0 C--N 1.321 -0.672 0 C-N-CA 123.162 0.585 . . . . 1.08 112.188 -176.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.752 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 18.7 t70 . . . . . 0 C--O 1.218 -0.583 0 N-CA-C 109.02 -0.733 . . . . 3.23 109.02 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.11 -2.3 5.41 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.013 0.745 . . . . 2.39 113.013 -169.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.16 -14.16 62.18 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.155 0.503 . . . . 3.2 110.059 170.105 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.752 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.1 ptpt -82.3 36.22 0.46 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.759 -0.655 . . . . 2.95 110.742 175.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.499 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 31.5 mmtm -44.97 116.1 1.02 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.624 -0.51 . . . . 3.72 109.624 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.606 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 60.4 ttt180 -96.87 164.49 12.53 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 108.755 -0.831 . . . . 4.12 108.755 -173.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 57.3 mttp -127.69 141.88 51.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.987 0.422 . . . . 4.59 110.023 171.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -82.69 -171.07 3.3 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.466 -0.788 . . . . 4.41 110.451 -176.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -61.27 -31.14 70.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 111.606 0.225 . . . . 5.69 111.606 -178.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.461 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 28.1 mt-10 -85.14 -18.81 33.04 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.079 -0.248 . . . . 5.38 111.332 -179.11 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 99.84 25.67 8.97 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.403 -0.903 . . . . 4.47 112.952 177.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.527 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 31.1 m-80 -90.47 144.69 25.56 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.233 -0.654 . . . . 4.72 109.233 176.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -69.86 91.45 0.65 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.883 0.373 . . . . 4.28 110.168 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.606 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.7 m -102.68 97.38 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 CA-C-O 122.014 0.911 . . . . 3.51 108.99 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.499 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 2.2 p -83.04 130.82 55.85 Favored Pre-proline 0 C--N 1.31 -1.15 0 CA-C-N 115.313 -0.858 . . . . 2.87 109.784 -178.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 47.8 Cg_exo . . . . . 0 CA--C 1.512 -0.599 0 C-N-CA 122.77 2.313 . . . . 2.06 111.993 -176.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.456 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 59.3 m-70 . . . . . 0 C--O 1.217 -0.619 0 N-CA-C 109.361 -0.607 . . . . 0.72 109.361 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 33.5 ttm -107.75 131.95 53.9 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.857 -0.737 . . . . 1.07 111.643 -176.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.518 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.7 m-85 -121.19 133.06 55.17 Favored 'General case' 0 C--O 1.215 -0.714 0 CA-C-N 115.5 -0.773 . . . . 0.27 109.869 177.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.743 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -80.05 159.23 26.24 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.231 -0.655 . . . . 1.68 109.231 176.501 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.55 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 18.7 m-85 -136.85 173.28 11.87 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.377 0.608 . . . . 0.32 112.021 -177.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -118.7 -21.46 7.87 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.043 -0.98 . . . . 2.7 110.208 178.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.421 ' HB2' HG21 ' A' ' 96' ' ' VAL . 53.4 m-80 -139.49 125.95 20.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.215 0.531 . . . . 1.16 110.74 -177.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.554 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.7 mmm180 -57.89 -30.88 66.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.192 -0.913 . . . . 3.7 111.997 177.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.7 m -64.27 -29.22 70.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.004 0.43 . . . . 1.13 110.554 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.721 ' HA ' ' ND2' ' A' ' 99' ' ' ASN . 5.2 t -85.15 -46.68 17.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 116.233 -0.44 . . . . 1.06 110.983 -177.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.554 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 10.2 ptp -61.72 -25.56 67.5 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.171 -0.612 . . . . 1.02 109.668 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 102' ' ' MET . 20.8 t70 -77.39 -38.59 49.57 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.137 -0.483 . . . . 0.34 110.642 172.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . 0.721 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 11.2 p30 -77.12 -33.58 56.79 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.705 0.261 . . . . 1.58 111.705 -175.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.536 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 39.2 mm -70.52 -56.02 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.529 0 N-CA-C 108.388 -0.967 . . . . 1.01 108.388 174.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.523 ' HB2' ' O ' ' A' ' 97' ' ' MET . 31.5 ttpt -48.89 -48.51 42.27 Favored 'General case' 0 C--O 1.218 -0.569 0 O-C-N 123.976 0.797 . . . . 1.47 109.752 176.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.764 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 40.7 ttp -48.44 -59.62 3.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.49 -0.777 . . . . 1.02 110.757 177.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.721 ' O ' HG13 ' A' ' 107' ' ' ILE . 60.0 m -57.77 -52.89 63.59 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.483 0.489 . . . . 1.04 110.71 -179.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 24.7 mt -47.28 -55.42 8.74 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.486 0.66 . . . . 1.04 110.527 175.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.5 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.3 mt-30 -51.69 -44.21 63.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.615 -1.175 . . . . 1.96 112.074 177.003 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.764 ' HG3' ' O ' ' A' ' 102' ' ' MET . 81.0 mt-30 -64.36 -35.47 80.97 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.725 0.774 . . . . 3.11 109.367 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.721 HG13 ' O ' ' A' ' 103' ' ' THR . 7.6 mt -75.95 -43.35 39.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 114.257 -1.338 . . . . 1.03 111.559 -176.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 104' ' ' LEU . 7.2 mt -62.19 -43.15 97.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.25 0.463 . . . . 1.04 112.25 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.439 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 24.2 t -62.45 -20.17 64.26 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.69 0.281 . . . . 1.67 111.279 -176.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -65.21 -44.21 89.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.518 0.675 . . . . 1.99 109.307 173.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -87.54 -11.78 47.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.088 -0.96 . . . . 1.0 110.303 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.439 ' CB ' ' HA ' ' A' ' 109' ' ' SER . 1.8 tpmt? . . . . . 0 C--N 1.324 -0.511 0 N-CA-C 108.795 -0.817 . . . . 1.46 108.795 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.433 ' HB3' ' HB ' ' A' ' 18' ' ' ILE . 75.9 m80 . . . . . 0 N--CA 1.472 0.665 0 N-CA-C 112.498 0.555 . . . . 1.08 112.498 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.2 t -153.03 157.74 40.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.779 0.8 . . . . 1.78 112.717 -169.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.472 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -176.08 -170.04 38.33 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 114.125 -1.398 . . . . 0.16 109.83 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -93.19 135.17 34.64 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 117.71 0.755 . . . . 1.04 110.375 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.412 ' HB2' ' HB3' ' A' ' 89' ' ' PHE . . . -145.85 146.04 30.98 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.275 -0.42 . . . . 1.02 111.367 -177.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.425 HG12 ' HA ' ' A' ' 13' ' ' SER . 85.1 mt -107.37 120.65 59.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.304 -0.407 . . . . 1.17 110.287 177.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -123.36 137.47 54.82 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.801 -0.814 . . . . 0.43 108.801 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 57.27 25.66 11.39 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.659 0.384 . . . . 0.8 110.736 -176.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt 69.14 5.63 5.2 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.774 0.657 . . . . 2.57 112.774 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -97.48 129.9 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 108.884 -0.784 . . . . 1.1 108.884 166.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.425 ' HA ' HG12 ' A' ' 8' ' ' ILE . 15.0 m -78.53 146.07 34.52 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.02 0.438 . . . . 1.5 110.861 -175.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.19 -160.18 11.69 Favored Glycine 0 N--CA 1.437 -1.273 0 C-N-CA 120.133 -1.032 . . . . 0.12 113.052 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.6 mm -126.05 133.11 69.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.148 -0.686 . . . . 1.02 109.148 -178.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.421 HD13 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.75 134.91 42.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 109.886 -0.413 . . . . 1.05 109.886 -176.862 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.95 130.61 31.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.568 0.223 . . . . 1.04 111.149 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.433 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 47.3 mt -86.6 139.4 17.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.311 0.577 . . . . 1.04 110.397 175.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -110.38 105.88 15.04 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 114.933 -1.03 . . . . 1.98 111.185 -176.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -116.9 170.41 8.64 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.146 -0.687 . . . . 1.2 109.146 174.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t70 77.78 -1.49 2.62 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 122.505 1.145 . . . . 0.58 109.399 -179.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.627 HG22 ' O ' ' A' ' 23' ' ' SER . 31.6 m -103.48 -171.86 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 113.559 -1.655 . . . . 1.05 109.383 177.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.627 ' O ' HG22 ' A' ' 22' ' ' VAL . 70.7 p -72.67 168.65 22.2 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 105.202 -2.148 . . . . 1.77 105.202 174.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -41.53 129.0 3.59 Favored 'Trans proline' 0 C--N 1.357 0.994 0 CA-C-N 121.501 1.572 . . . . 0.19 112.368 -145.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.438 ' HB1' ' CG2' ' A' ' 107' ' ' ILE . . . -52.56 142.17 18.64 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 114.164 -1.38 . . . . 1.03 112.381 -162.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.76 168.68 12.87 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.64 -1.163 . . . . 0.32 112.019 -170.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.511 ' HB3' HG23 ' A' ' 40' ' ' VAL . 3.1 tm? -119.79 108.97 15.04 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.798 -1.186 . . . . 1.02 107.798 175.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m -103.98 107.08 17.81 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 120.761 0.315 . . . . 1.02 111.1 -176.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.417 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 86.9 t90 -86.85 129.04 35.04 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.122 -0.696 . . . . 0.17 109.122 171.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.446 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 92.0 mtt180 -123.32 160.55 26.48 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.059 -0.719 . . . . 2.24 109.059 172.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.4 p -70.65 175.72 4.7 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.204 -0.665 . . . . 0.63 109.204 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.0 p -59.32 -35.88 74.62 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.221 -0.592 . . . . 0.96 111.104 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -88.39 -32.56 18.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.579 0.704 . . . . 2.12 109.396 171.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.446 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 98.56 14.79 36.69 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 114.957 -1.019 . . . . 0.23 113.339 173.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -67.47 -40.96 85.31 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.186 0.517 . . . . 1.73 109.776 174.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.2 135.58 33.52 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.577 -0.897 . . . . 1.91 108.577 174.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 12.0 p -149.46 140.26 16.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 C-N-CA 120.846 -0.342 . . . . 1.04 111.461 -177.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -144.32 125.4 14.51 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.832 -0.432 . . . . 0.54 109.832 175.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 41.1 m -109.26 137.63 46.84 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.752 0.279 . . . . 1.04 111.752 -175.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.511 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -107.98 128.84 63.02 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 108.329 -0.989 . . . . 1.04 108.329 169.583 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 79.5 t -92.84 120.02 41.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 O-C-N 121.234 -0.916 . . . . 1.02 108.781 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.45 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -69.08 -19.59 64.07 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.077 0.769 . . . . 1.01 113.077 -169.194 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.6 p -69.46 -14.87 63.12 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 119.821 -0.752 . . . . 1.07 109.553 175.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.6 p -109.93 11.34 24.16 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.477 -0.783 . . . . 1.03 109.921 -179.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.508 HG23 ' CD1' ' A' ' 62' ' ' LEU . 20.5 mm -111.84 139.88 34.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.718 -0.674 . . . . 1.01 109.263 178.028 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -108.44 -40.73 5.04 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.396 -0.365 . . . . 0.52 110.914 -176.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.52 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 34.6 mtpt -132.61 167.83 19.34 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.709 0.766 . . . . 1.95 111.402 -178.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.485 HD11 ' HG2' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -150.77 132.69 15.12 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.432 -1.258 . . . . 1.39 107.862 174.811 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.459 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -133.06 114.76 14.3 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.329 -0.249 . . . . 2.02 110.329 -172.413 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.429 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . . . -110.09 145.16 37.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.827 0.346 . . . . 1.05 110.981 -178.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.406 HG23 ' HB3' ' A' ' 57' ' ' LYS . 76.4 p -67.54 118.42 56.91 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.765 -0.652 . . . . 1.05 110.781 -177.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.556 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 9.6 Cg_exo -59.82 163.16 14.12 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.445 2.097 . . . . 0.44 111.737 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.96 -8.05 53.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.199 -0.455 . . . . 1.21 111.032 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.4 t -94.22 -4.82 48.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.358 0.599 . . . . 1.94 109.676 174.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.556 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 33.9 m -87.65 143.23 27.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.601 -0.727 . . . . 1.13 111.175 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -69.24 -12.07 61.35 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.031 -0.986 . . . . 1.77 110.615 175.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.448 ' HG2' ' HE1' ' A' ' 59' ' ' MET . 1.4 mptp? -99.86 154.06 18.65 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 114.894 -1.048 . . . . 2.18 111.391 -174.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.432 ' HE3' ' HE2' ' A' ' 97' ' ' MET . 80.5 mmm -127.67 98.25 5.13 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.109 -0.7 . . . . 1.11 109.109 168.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.468 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.2 OUTLIER -156.36 155.59 32.45 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.869 -0.605 . . . . 1.05 111.644 -173.205 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.441 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.5 tt -130.81 119.15 21.84 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.363 -0.977 . . . . 1.05 108.363 175.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.5 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 52.2 mtm180 -101.24 146.32 27.69 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.877 0.37 . . . . 3.5 111.288 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.515 HD21 HD12 ' A' ' 104' ' ' LEU . 1.2 mm? -128.15 106.75 9.27 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.399 -0.819 . . . . 1.03 109.565 179.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.568 ' N ' HD13 ' A' ' 63' ' ' ILE . 2.6 mp -95.71 113.97 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 122.509 0.323 . . . . 1.11 110.478 -172.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.471 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -65.25 169.22 28.57 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 121.26 -0.495 . . . . 0.54 113.194 178.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 77.3 mttt . . . . . 0 C--N 1.319 -0.739 0 CA-C-O 120.871 0.367 . . . . 1.08 110.926 177.807 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.765 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.1 t70 . . . . . 0 C--O 1.217 -0.622 0 N-CA-C 108.119 -1.067 . . . . 3.23 108.119 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -73.16 -2.24 20.79 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.847 0.314 . . . . 2.39 111.847 -170.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.8 p -71.53 -6.3 39.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.36 0.6 . . . . 3.2 110.166 171.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.765 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 17.8 ptmt -91.35 36.17 0.93 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.677 -0.692 . . . . 2.95 110.402 175.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.525 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 13.1 mmmt -44.33 113.93 0.61 Allowed 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.132 -0.692 . . . . 3.72 109.132 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.592 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.0 ttt180 -102.4 167.02 10.22 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.621 -0.718 . . . . 4.12 109.303 -168.246 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.488 ' N ' ' HG2' ' A' ' 72' ' ' ARG . 56.5 mttp -132.6 128.46 37.2 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.642 -0.503 . . . . 4.59 109.642 171.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -83.3 -166.06 1.26 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.026 -0.534 . . . . 4.41 110.021 -178.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -58.79 -26.16 63.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.913 0.387 . . . . 5.69 111.554 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -87.27 -7.44 57.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.937 -0.574 . . . . 5.38 111.782 -174.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.57 3.65 88.97 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.736 -0.745 . . . . 4.47 112.347 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.411 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 93.9 m-20 -71.19 139.64 50.23 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.438 -0.579 . . . . 4.72 109.438 175.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.496 ' CD ' ' HE3' ' A' ' 71' ' ' LYS . 34.3 tt0 -72.1 90.39 1.19 Allowed 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.529 -0.545 . . . . 4.28 109.529 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.592 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 31.3 m -92.68 99.51 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.168 0 CA-C-O 121.785 0.803 . . . . 3.51 109.208 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.525 ' HB ' ' HD2' ' A' ' 71' ' ' LYS . 0.8 OUTLIER -80.03 108.38 9.14 Favored Pre-proline 0 C--N 1.309 -1.165 0 N-CA-C 108.813 -0.81 . . . . 2.87 108.813 175.951 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo . . . . . 0 CA--C 1.513 -0.527 0 C-N-CA 123.363 2.709 . . . . 2.06 112.953 -170.601 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 78.3 m-70 . . . . . 0 N--CA 1.449 -0.496 0 N-CA-C 108.69 -0.856 . . . . 0.72 108.69 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.434 ' SD ' ' HE2' ' A' ' 59' ' ' MET . 32.6 ttm -141.34 129.46 22.1 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.396 -0.522 . . . . 1.07 110.838 173.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.412 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 8.7 m-85 -118.19 127.42 53.73 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.611 -0.722 . . . . 0.27 109.565 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.468 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -80.69 153.55 27.82 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 109.825 -0.435 . . . . 1.68 109.825 177.205 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.441 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 22.1 m-85 -133.58 170.3 15.72 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.247 0.546 . . . . 0.32 111.543 -174.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -117.51 -13.86 10.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.245 -0.889 . . . . 2.7 109.927 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.443 ' HB2' HG23 ' A' ' 96' ' ' VAL . 57.1 m-80 -141.31 126.17 18.13 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.038 0.447 . . . . 1.16 110.432 -177.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.453 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.5 mmm180 -62.33 -34.13 76.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.413 -0.812 . . . . 3.7 111.816 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.7 m -63.05 -32.67 74.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.404 -0.362 . . . . 1.13 110.793 -177.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.538 ' O ' HG12 ' A' ' 100' ' ' ILE . 11.8 t -71.04 -57.45 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 116.206 -0.452 . . . . 1.06 110.284 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.453 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.6 ptp -56.53 -39.07 72.73 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.974 -0.557 . . . . 1.02 111.136 -176.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.426 ' N ' ' HG3' ' A' ' 97' ' ' MET . 16.0 t70 -65.13 -39.44 93.04 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.804 -0.358 . . . . 0.34 110.36 179.042 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -75.08 -39.9 60.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.247 -0.433 . . . . 1.58 111.763 -179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.2 mm -63.89 -55.52 21.84 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.361 0 N-CA-C 108.656 -0.868 . . . . 1.01 108.656 176.007 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 31.4 ttpt -51.05 -47.51 61.75 Favored 'General case' 0 C--O 1.218 -0.565 0 O-C-N 123.827 0.704 . . . . 1.47 109.885 176.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.675 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 35.2 ttp -50.33 -56.3 11.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.626 -0.715 . . . . 1.02 110.999 177.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.7 ' O ' HG13 ' A' ' 107' ' ' ILE . 40.5 m -58.32 -53.29 59.99 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.482 0.489 . . . . 1.04 110.557 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 25.8 mt -47.23 -54.38 10.95 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.722 -0.672 . . . . 1.04 110.631 175.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.485 ' HG2' HD11 ' A' ' 48' ' ' LEU . 44.1 mt-30 -51.25 -46.63 62.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.698 -1.137 . . . . 1.96 112.223 177.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' A' ' 102' ' ' MET . 18.9 mt-30 -60.04 -40.46 89.49 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-O 122.006 0.908 . . . . 3.11 108.864 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.7 HG13 ' O ' ' A' ' 103' ' ' THR . 7.4 mt -69.15 -46.5 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 CA-C-N 113.878 -1.51 . . . . 1.03 111.165 -178.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.475 HD12 HD13 ' A' ' 48' ' ' LEU . 6.0 mt -62.24 -42.19 94.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.223 -0.444 . . . . 1.04 111.635 -177.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.9 t -56.88 -29.69 63.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.655 0.264 . . . . 1.67 111.022 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -61.1 -42.11 97.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.459 0.647 . . . . 1.99 109.905 176.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -92.43 -3.93 54.49 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.217 -0.901 . . . . 1.0 110.22 -178.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 115.316 -0.856 . . . . 1.46 108.884 176.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.429 ' HA ' HD11 ' A' ' 18' ' ' ILE . 25.1 m80 . . . . . 0 CA--C 1.513 -0.472 0 N-CA-C 110.071 -0.344 . . . . 1.08 110.071 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 56.9 p -157.24 168.47 27.32 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.184 -0.607 . . . . 1.78 111.997 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.437 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 175.83 -169.11 41.72 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.108 -0.951 . . . . 0.16 110.814 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -98.07 129.07 44.92 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 117.237 0.519 . . . . 1.04 110.164 177.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.47 145.68 32.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.866 0.365 . . . . 1.02 111.477 -176.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.423 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 83.1 mt -102.89 129.95 53.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 116.332 -0.394 . . . . 1.17 110.091 176.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.472 ' O ' HG13 ' A' ' 12' ' ' VAL . 26.0 t80 -141.85 141.02 33.07 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 108.871 -0.788 . . . . 0.43 108.871 178.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 62.48 24.99 14.9 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.826 -0.435 . . . . 0.8 109.826 -176.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt 64.61 1.72 1.43 Allowed 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 113.54 0.941 . . . . 2.57 113.54 -177.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.472 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -95.79 125.51 48.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 108.722 -0.844 . . . . 1.1 108.722 169.633 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.408 ' HA ' HG12 ' A' ' 8' ' ' ILE . 59.4 p -75.6 145.13 41.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.799 0.333 . . . . 1.5 110.483 -176.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.445 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -160.82 -160.28 10.57 Favored Glycine 0 N--CA 1.438 -1.169 0 C-N-CA 119.742 -1.218 . . . . 0.12 113.926 -175.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.3 mm -125.71 131.76 71.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 N-CA-C 108.935 -0.765 . . . . 1.02 108.935 -179.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.439 ' CD1' HD13 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.33 136.98 33.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 110.272 -0.27 . . . . 1.05 110.272 -176.357 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.72 130.1 31.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.911 0.386 . . . . 1.04 111.486 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.476 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 54.7 mt -86.43 135.25 25.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 109.918 -0.401 . . . . 1.04 109.918 177.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.0 101.06 10.17 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.156 -0.475 . . . . 1.98 110.694 -176.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -114.42 169.73 8.83 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.431 -0.581 . . . . 1.2 109.431 176.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t70 76.01 -1.56 2.93 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.966 0.888 . . . . 0.58 109.96 -177.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.593 HG21 ' O ' ' A' ' 23' ' ' SER . 31.6 m -102.62 -174.87 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 114.472 -1.24 . . . . 1.05 109.928 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.593 ' O ' HG21 ' A' ' 22' ' ' VAL . 58.3 m -73.84 164.03 64.08 Favored Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 105.045 -2.206 . . . . 1.77 105.045 174.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -41.18 127.73 2.94 Favored 'Trans proline' 0 C--N 1.352 0.73 0 CA-C-N 121.15 1.446 . . . . 0.19 112.629 -137.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.623 ' H ' ' HH ' ' A' ' 111' ' ' TYR . . . -51.49 141.27 16.16 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 113.713 -1.585 . . . . 1.03 112.164 -165.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -125.43 166.76 16.01 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 114.37 -1.286 . . . . 0.32 111.844 -170.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.5 ' HB3' HG23 ' A' ' 40' ' ' VAL . 3.3 tm? -115.53 105.03 12.33 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 107.422 -1.325 . . . . 1.02 107.422 173.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.8 m -99.03 106.9 19.2 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 120.933 0.397 . . . . 1.02 111.056 -176.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -84.48 132.56 34.53 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.907 -0.775 . . . . 0.17 108.907 171.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.449 ' HG2' HG23 ' A' ' 37' ' ' VAL . 66.6 mtt180 -124.6 159.09 31.51 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 108.463 -0.94 . . . . 2.24 108.463 174.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.0 p -71.96 177.57 4.23 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.987 -0.746 . . . . 0.63 108.987 177.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.445 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.2 p -60.19 -33.84 72.79 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.969 -0.692 . . . . 0.96 110.898 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -87.73 -31.63 19.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.76 0.79 . . . . 2.12 109.394 171.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.432 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 93.02 11.02 59.22 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 114.51 -1.223 . . . . 0.23 112.29 177.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -60.58 -45.23 94.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.343 -0.614 . . . . 1.73 109.343 173.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.5 tttm -83.52 138.68 33.31 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.652 -0.87 . . . . 1.91 108.652 172.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.449 HG23 ' HG2' ' A' ' 30' ' ' ARG . 9.8 p -143.81 139.88 25.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 120.849 0.356 . . . . 1.04 110.552 -178.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -145.09 115.19 7.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.578 -0.283 . . . . 0.54 110.321 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 50.8 m -108.19 133.74 52.03 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.607 0.595 . . . . 1.04 112.607 -174.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.5 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.35 130.17 52.66 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.587 0 N-CA-C 108.082 -1.081 . . . . 1.04 108.082 168.989 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.404 ' O ' HG12 ' A' ' 45' ' ' ILE . 74.5 t -93.01 120.68 42.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 O-C-N 121.193 -0.942 . . . . 1.02 109.199 173.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -68.73 -20.5 64.39 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.916 0.71 . . . . 1.01 112.916 -170.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.5 p -67.49 -18.1 64.93 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.948 -0.76 . . . . 1.07 108.948 176.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.405 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 5.3 p -109.03 14.1 24.22 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.142 -0.936 . . . . 1.03 110.07 -177.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.463 ' HA ' ' HA2' ' A' ' 64' ' ' GLY . 24.7 mm -110.06 138.76 36.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.168 -0.679 . . . . 1.01 109.168 177.279 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.443 ' HB2' ' HG2' ' A' ' 65' ' ' LYS . 37.2 t70 -101.84 -41.58 6.46 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.278 -0.419 . . . . 0.52 110.487 -176.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.411 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 13.1 mtmt -144.51 175.75 9.9 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.983 0.42 . . . . 1.95 111.255 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.446 ' CD2' ' HB3' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -151.81 140.35 20.65 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.704 -0.85 . . . . 1.39 108.704 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -139.72 115.89 10.44 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.047 0.385 . . . . 2.02 111.734 -173.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.467 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . . . -111.26 144.84 39.78 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.73 0.3 . . . . 1.05 111.661 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.404 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 61.2 p -64.76 123.71 84.22 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-N 115.827 -0.624 . . . . 1.05 110.898 -177.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.453 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 35.1 Cg_exo -54.97 157.16 13.76 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.658 2.239 . . . . 0.44 111.417 175.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.59 -19.78 65.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.224 -0.444 . . . . 1.21 111.814 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 t -93.29 -14.45 26.96 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.166 0.508 . . . . 1.94 110.443 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.453 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 17.6 m -65.95 137.39 57.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.672 -0.695 . . . . 1.13 111.299 177.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -50.55 -34.86 27.15 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-N 114.748 -1.115 . . . . 1.77 110.419 172.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.469 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 34.4 mmtt -86.3 149.99 24.66 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 113.449 -1.705 . . . . 2.18 112.123 -171.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.428 ' O ' ' HG3' ' A' ' 59' ' ' MET . 4.3 mtp -128.82 98.53 5.0 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.831 -1.077 . . . . 1.11 109.238 171.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.503 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.4 OUTLIER -156.49 156.33 33.54 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.651 -0.704 . . . . 1.05 111.045 -171.888 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.452 HD13 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -129.87 119.07 22.71 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.049 -1.093 . . . . 1.05 108.049 175.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.532 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 47.9 mtm180 -99.97 141.98 32.06 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.208 0.528 . . . . 3.5 110.788 -178.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.528 HD23 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -120.36 104.62 10.18 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 114.97 -1.014 . . . . 1.03 108.814 177.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.51 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.9 mp -84.37 97.21 4.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.285 -0.635 . . . . 1.11 109.285 -174.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.463 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -72.59 148.68 42.32 Favored Glycine 0 N--CA 1.442 -0.942 0 CA-C-N 115.461 -0.791 . . . . 0.54 111.904 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.443 ' HG2' ' HB2' ' A' ' 46' ' ' ASP . 91.9 mttt . . . . . 0 C--N 1.313 -1.001 0 CA-C-O 121.027 0.441 . . . . 1.08 111.793 -176.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.673 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 12.7 m-20 . . . . . 0 N--CA 1.449 -0.496 0 N-CA-C 108.384 -0.969 . . . . 3.23 108.384 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.47 -2.88 3.65 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.187 -0.46 . . . . 2.39 112.039 -171.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.7 p -67.9 -16.1 63.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.376 0.608 . . . . 3.2 110.336 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.673 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.5 ptpt -79.55 42.88 0.53 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.584 -0.735 . . . . 2.95 111.188 177.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -44.24 116.68 1.06 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.328 0.585 . . . . 3.72 109.921 -176.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -105.89 165.83 10.92 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.072 -0.967 . . . . 4.12 109.853 -166.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 61.7 mttp -130.63 139.35 50.38 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.925 -0.398 . . . . 4.59 109.925 170.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.484 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 2.9 p-10 -86.62 -168.6 2.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.017 -0.538 . . . . 4.41 110.377 -177.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -58.9 -31.2 68.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.705 0.288 . . . . 5.69 111.618 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.484 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 16.5 mt-10 -80.18 -14.9 58.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 5.38 110.898 -179.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.94 16.54 59.43 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.738 -0.744 . . . . 4.47 111.695 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.581 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 53.4 m-20 -77.11 138.98 39.84 Favored 'General case' 0 CA--C 1.512 -0.519 0 N-CA-C 109.043 -0.725 . . . . 4.72 109.043 178.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -69.79 90.08 0.59 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.49 -0.559 . . . . 4.28 109.49 176.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 27.9 m -96.32 123.87 48.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.565 0.698 . . . . 3.51 110.044 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.435 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 t -90.59 122.47 67.07 Favored Pre-proline 0 C--N 1.313 -1.002 0 N-CA-C 108.452 -0.944 . . . . 2.87 108.452 177.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 33.4 Cg_exo . . . . . 0 CA--C 1.513 -0.574 0 C-N-CA 123.009 2.473 . . . . 2.06 111.642 -176.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.532 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 77.4 m-70 . . . . . 0 C--O 1.22 -0.499 0 N-CA-C 107.785 -1.191 . . . . 0.72 107.785 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.503 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 27.6 ttm -140.29 125.91 19.17 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 118.891 0.769 . . . . 1.07 111.775 175.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.435 ' O ' ' HA ' ' A' ' 59' ' ' MET . 10.1 m-85 -112.82 127.26 56.12 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.39 -0.823 . . . . 0.27 109.842 178.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.6 OUTLIER -81.12 149.51 29.13 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.924 0.392 . . . . 1.68 110.284 177.388 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 25.0 m-85 -131.71 174.16 10.41 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.297 0.57 . . . . 0.32 111.533 -174.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -119.51 -21.18 7.5 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.017 -0.992 . . . . 2.7 109.572 175.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.456 ' HB2' HG23 ' A' ' 96' ' ' VAL . 11.1 m120 -130.55 126.89 37.9 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.046 -0.525 . . . . 1.16 110.525 -173.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.552 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 10.6 mmm180 -64.4 -32.86 74.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.627 -0.715 . . . . 3.7 111.874 178.083 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.2 m -62.34 -39.0 91.65 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.89 0.376 . . . . 1.13 110.937 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.553 ' O ' HG12 ' A' ' 100' ' ' ILE . 13.0 t -67.84 -55.21 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-N 116.025 -0.534 . . . . 1.06 110.384 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.552 ' SD ' ' HD2' ' A' ' 94' ' ' ARG . 13.2 ptp -59.05 -36.15 74.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.268 -0.424 . . . . 1.02 111.05 -176.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -64.35 -45.53 87.37 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.55 -0.296 . . . . 0.34 110.274 176.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -70.2 -42.91 71.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.999 -0.546 . . . . 1.58 111.868 -177.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.564 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 38.8 mm -61.41 -55.93 21.2 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 109.024 -0.732 . . . . 1.01 109.024 178.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.467 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 21.2 ttpp -51.36 -51.23 56.37 Favored 'General case' 0 C--O 1.218 -0.584 0 O-C-N 123.742 0.652 . . . . 1.47 110.05 177.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.592 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 45.8 ttp -46.82 -53.45 11.98 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.061 -0.972 . . . . 1.02 111.365 177.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.715 ' O ' HG13 ' A' ' 107' ' ' ILE . 20.0 m -62.56 -52.23 64.23 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.201 -0.454 . . . . 1.04 110.751 179.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 33.0 mt -47.22 -53.36 13.45 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.646 0.736 . . . . 1.04 110.62 175.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 101' ' ' LYS . 57.4 mt-30 -55.29 -39.8 70.32 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.258 -1.337 . . . . 1.96 112.125 177.43 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.592 ' HG2' ' O ' ' A' ' 102' ' ' MET . 25.9 mm-40 -69.25 -25.67 64.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.556 0.693 . . . . 3.11 110.218 178.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 103' ' ' THR . 18.4 mt -82.18 -46.15 19.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 114.952 -1.022 . . . . 1.03 111.08 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 104' ' ' LEU . 11.0 mt -62.68 -40.4 88.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.039 -0.528 . . . . 1.04 111.541 -176.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.5 p -61.44 -20.63 63.32 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.373 -0.376 . . . . 1.67 111.802 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -66.28 -51.99 51.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.587 0.708 . . . . 1.99 109.309 173.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.623 ' HH ' ' H ' ' A' ' 25' ' ' ALA . 51.8 m-85 -78.18 -16.58 57.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.081 -0.963 . . . . 1.0 110.374 -178.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 115.392 -0.822 . . . . 1.46 109.329 174.356 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 70.7 m80 . . . . . 0 N--CA 1.473 0.679 0 N-CA-C 112.235 0.457 . . . . 1.08 112.235 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.0 p -150.63 165.31 33.76 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.089 0.774 . . . . 1.78 113.089 -170.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.436 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -179.76 -161.8 27.65 Favored Glycine 0 N--CA 1.443 -0.862 0 CA-C-N 114.472 -1.24 . . . . 0.16 110.434 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.92 133.53 47.88 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.438 0.619 . . . . 1.04 110.407 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -147.47 148.1 30.89 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.17 0.433 . . . . 1.02 112.17 -176.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.788 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.7 mt -107.66 124.19 63.54 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-O 120.818 0.342 . . . . 1.17 110.915 177.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -123.78 133.81 53.76 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.739 -0.837 . . . . 0.43 108.739 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 53.95 32.06 14.62 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 122.804 0.441 . . . . 0.8 110.947 -177.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.4 mtpt 70.98 -1.82 2.55 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.435 0.902 . . . . 2.57 113.435 178.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.4 p -92.56 118.78 38.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.792 -0.818 . . . . 1.1 108.792 169.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.3 p -72.93 145.93 46.45 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.161 -0.472 . . . . 1.5 110.656 -176.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . 0.417 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -163.82 -157.44 9.35 Favored Glycine 0 N--CA 1.439 -1.164 0 C-N-CA 120.106 -1.045 . . . . 0.12 113.214 -177.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.1 mm -126.17 132.12 70.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 109.404 -0.591 . . . . 1.02 109.404 -178.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.426 HD12 HD13 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -100.74 134.89 39.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.859 -0.423 . . . . 1.05 109.859 -177.453 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.4 128.78 28.12 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.502 -0.317 . . . . 1.04 111.443 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.414 HD11 ' HB ' ' A' ' 103' ' ' THR . 46.9 mt -85.46 138.67 18.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 121.267 0.556 . . . . 1.04 109.973 175.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -110.42 103.28 11.9 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 114.917 -1.038 . . . . 1.98 110.947 -175.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -116.58 169.05 9.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.319 -0.623 . . . . 1.2 109.319 175.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.7 t70 78.35 -3.31 2.31 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 122.251 1.025 . . . . 0.58 109.664 -176.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.63 HG21 ' O ' ' A' ' 23' ' ' SER . 27.1 m -102.82 -174.55 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 113.918 -1.492 . . . . 1.05 109.331 178.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.63 ' O ' HG21 ' A' ' 22' ' ' VAL . 64.6 m -72.94 167.92 29.46 Favored Pre-proline 0 C--N 1.314 -0.964 0 N-CA-C 105.404 -2.073 . . . . 1.77 105.404 175.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.401 ' O ' HG13 ' A' ' 41' ' ' VAL . 93.7 Cg_exo -41.15 129.34 3.11 Favored 'Trans proline' 0 C--N 1.354 0.82 0 CA-C-N 121.166 1.452 . . . . 0.19 112.531 -141.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.432 ' HB2' ' CG2' ' A' ' 107' ' ' ILE . . . -52.83 138.75 28.76 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 114.182 -1.372 . . . . 1.03 112.2 -162.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -118.89 167.44 11.72 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.094 -0.957 . . . . 0.32 111.797 -171.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.488 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.1 tm? -116.75 105.59 12.56 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 106.988 -1.486 . . . . 1.02 106.988 170.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 m -102.43 106.28 16.99 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 120.885 0.374 . . . . 1.02 110.801 -174.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -86.29 129.42 34.86 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 109.009 -0.737 . . . . 0.17 109.009 173.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.461 ' HG2' HG21 ' A' ' 37' ' ' VAL . 73.4 mtt180 -124.15 157.48 34.57 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.365 -0.976 . . . . 2.24 108.365 173.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 p -68.08 175.45 3.16 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.076 -0.712 . . . . 0.63 109.076 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.417 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 7.0 p -57.27 -44.27 83.8 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 118.362 0.528 . . . . 0.96 110.678 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -82.73 -26.38 32.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.753 -0.658 . . . . 2.12 109.719 172.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.13 16.49 47.17 Favored Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.184 -0.916 . . . . 0.23 112.885 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -62.16 -54.03 46.85 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.478 -0.564 . . . . 1.73 109.478 174.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt -80.93 140.3 35.37 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.517 -0.765 . . . . 1.91 109.186 176.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.461 HG21 ' HG2' ' A' ' 30' ' ' ARG . 14.9 p -149.32 134.81 11.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.022 0.439 . . . . 1.04 111.078 -178.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -139.83 129.16 24.01 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.484 -0.561 . . . . 0.54 109.484 178.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m -117.56 129.26 55.67 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.262 0.468 . . . . 1.04 112.262 -172.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.488 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -97.3 128.99 48.02 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.629 0 N-CA-C 107.797 -1.186 . . . . 1.04 107.797 168.775 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.401 HG13 ' O ' ' A' ' 24' ' ' PRO . 68.0 t -92.72 120.8 42.68 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 N-CA-C 108.208 -1.034 . . . . 1.02 108.208 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -67.04 -20.7 65.89 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.19 0.811 . . . . 1.01 113.19 -169.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.7 p -68.41 -15.53 63.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.225 0.536 . . . . 1.07 109.906 175.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.2 p -106.26 9.93 31.91 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.531 -0.758 . . . . 1.03 109.874 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.474 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 25.7 mm -111.9 143.33 21.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.876 -0.602 . . . . 1.01 109.515 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -107.03 -44.69 4.33 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.392 -0.367 . . . . 0.52 110.72 -178.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.478 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 9.6 mtmm -138.92 171.53 14.19 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.452 -0.34 . . . . 1.95 111.212 -176.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.517 HD12 ' CG ' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -150.64 135.4 17.4 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.21 -0.663 . . . . 1.39 109.21 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.507 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 79.7 mm-40 -131.57 120.11 22.43 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 111.934 0.346 . . . . 2.02 111.934 -170.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.18 141.93 47.49 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 121.974 -0.454 . . . . 1.05 111.937 -177.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.6 p -68.58 121.96 82.88 Favored Pre-proline 0 N--CA 1.464 0.261 0 CA-C-N 115.848 -0.615 . . . . 1.05 110.712 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.482 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 11.1 Cg_exo -59.57 161.08 18.5 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.395 2.063 . . . . 0.44 111.433 175.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.84 -23.51 66.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.003 0.43 . . . . 1.21 110.748 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 42.5 m -76.41 -19.26 58.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.641 . . . . 1.94 110.648 176.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.482 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 73.2 m -78.15 134.47 37.65 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.373 -0.831 . . . . 1.13 110.316 177.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -57.96 -26.49 62.36 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 121.708 0.765 . . . . 1.77 110.673 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.571 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 42.4 mmtm -77.81 151.74 33.81 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 114.56 -1.2 . . . . 2.18 111.435 -176.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.556 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -127.31 95.57 4.31 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 107.927 -1.138 . . . . 1.11 107.927 168.628 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.571 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.13 151.66 28.54 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 121.62 0.724 . . . . 1.05 112.084 -173.537 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 97' ' ' MET . 1.9 tt -127.76 119.32 25.5 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.408 -1.269 . . . . 1.05 107.936 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.573 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 30.3 mtm180 -101.01 144.98 29.29 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.111 0.481 . . . . 3.5 111.119 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.53 HD23 HD12 ' A' ' 104' ' ' LEU . 1.1 mm? -122.64 106.18 10.74 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.208 -0.905 . . . . 1.03 109.097 178.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.577 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -85.34 98.77 6.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.742 -0.466 . . . . 1.11 109.742 -173.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.454 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -74.03 136.73 22.03 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.752 -0.658 . . . . 0.54 112.443 -178.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.474 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 82.0 mttt . . . . . 0 C--N 1.322 -0.596 0 N-CA-C 112.831 0.678 . . . . 1.08 112.831 -176.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.713 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 15.3 t70 . . . . . 0 C--O 1.211 -0.96 0 N-CA-C 109.222 -0.659 . . . . 3.23 109.222 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -65.65 -3.49 4.78 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.676 0.621 . . . . 2.39 112.676 -169.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.0 p -75.89 -7.93 55.7 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.26 0.552 . . . . 3.2 110.239 170.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.713 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.9 ptmt -80.17 37.45 0.38 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.44 -0.8 . . . . 2.95 110.719 176.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.523 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 29.8 mmtm -45.23 114.54 0.75 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.945 -0.571 . . . . 3.72 110.354 -175.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.603 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.0 ttt180 -91.26 158.88 16.33 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 107.909 -1.145 . . . . 4.12 107.909 -176.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 97.3 mttt -134.4 140.56 46.38 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 109.535 -0.543 . . . . 4.59 109.535 174.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.464 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 1.6 p-10 -80.14 -169.46 2.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.126 -0.488 . . . . 4.41 110.527 -177.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -58.53 -31.75 68.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.727 0.298 . . . . 5.69 111.662 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.51 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 16.5 mt-10 -83.7 -32.42 25.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.744 0.307 . . . . 5.38 110.921 -178.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 113.78 18.24 7.04 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.594 -0.813 . . . . 4.47 112.32 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.51 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 32.2 m-80 -76.11 131.81 39.65 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.172 -0.677 . . . . 4.72 109.172 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.08 96.38 0.62 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.098 0.475 . . . . 4.28 109.932 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.603 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.7 m -105.45 99.32 8.24 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-O 121.605 0.716 . . . . 3.51 109.077 177.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.523 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -87.53 121.31 71.16 Favored Pre-proline 0 C--N 1.312 -1.033 0 CA-C-N 116.078 -0.51 . . . . 2.87 110.2 -177.723 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.434 ' HG2' ' HE2' ' A' ' 70' ' ' LYS . 52.1 Cg_exo . . . . . 0 N--CA 1.458 -0.608 0 C-N-CA 122.975 2.45 . . . . 2.06 112.135 -178.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.573 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 66.0 m-70 . . . . . 0 CA--C 1.509 -0.604 0 N-CA-C 107.497 -1.297 . . . . 0.72 107.497 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.556 ' SD ' ' HE2' ' A' ' 59' ' ' MET . 35.2 ttm -140.4 127.11 20.4 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 119.687 -0.805 . . . . 1.07 111.666 179.063 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.5 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 6.0 m-85 -118.11 130.04 55.9 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.418 -0.81 . . . . 0.27 109.536 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.788 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -79.71 159.33 26.68 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.718 -0.475 . . . . 1.68 109.718 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.458 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 28.8 m-85 -138.73 175.33 9.65 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 120.752 0.311 . . . . 0.32 110.765 -178.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -124.02 -12.3 7.49 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.851 -0.613 . . . . 2.7 109.823 173.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.442 ' HB2' HG23 ' A' ' 96' ' ' VAL . 46.6 m-80 -138.06 128.3 26.03 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.067 -0.515 . . . . 1.16 110.252 -177.595 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.538 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 13.9 mmm180 -67.24 -30.23 70.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.528 -0.76 . . . . 3.7 111.85 -179.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.9 m -61.88 -39.8 93.18 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.979 0.418 . . . . 1.13 110.549 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.569 ' O ' HG12 ' A' ' 100' ' ' ILE . 8.1 t -65.92 -56.03 16.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.899 -0.591 . . . . 1.06 110.4 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.538 ' SD ' ' HD2' ' A' ' 94' ' ' ARG . 14.8 ptp -57.44 -38.03 73.78 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 116.235 -0.439 . . . . 1.02 111.067 -176.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.53 -43.58 93.54 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.449 -0.5 . . . . 0.34 110.466 177.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -70.65 -39.28 73.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.141 -0.482 . . . . 1.58 111.585 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.569 HG12 ' O ' ' A' ' 96' ' ' VAL . 34.0 mm -63.89 -56.99 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 108.895 -0.779 . . . . 1.01 108.895 175.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.423 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 31.1 ttpt -49.99 -48.75 52.2 Favored 'General case' 0 C--O 1.22 -0.47 0 O-C-N 123.926 0.766 . . . . 1.47 109.793 176.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.668 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 41.9 ttp -49.09 -56.36 9.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.54 -0.755 . . . . 1.02 111.201 177.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.72 ' O ' HG13 ' A' ' 107' ' ' ILE . 32.3 m -58.5 -53.49 57.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.15 -0.477 . . . . 1.04 110.596 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.53 HD12 HD23 ' A' ' 62' ' ' LEU . 26.1 mt -47.5 -53.61 13.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.705 -0.68 . . . . 1.04 110.569 175.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.517 ' CG ' HD12 ' A' ' 48' ' ' LEU . 93.9 mt-30 -53.36 -44.06 68.27 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.524 -1.216 . . . . 1.96 112.182 176.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.7 mt-30 -62.95 -35.75 81.16 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.753 0.787 . . . . 3.11 109.086 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.72 HG13 ' O ' ' A' ' 103' ' ' THR . 9.3 mt -74.43 -45.63 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-N 114.326 -1.307 . . . . 1.03 111.417 -177.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.8 mt -63.8 -40.66 89.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.449 -0.341 . . . . 1.04 111.699 -177.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.7 t -56.31 -24.76 45.66 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.979 0.418 . . . . 1.67 111.045 -178.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -65.65 -40.94 93.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.214 0.53 . . . . 1.99 110.255 176.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -90.9 -16.78 27.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.635 -0.711 . . . . 1.0 109.984 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.427 0 CA-C-N 115.135 -0.939 . . . . 1.46 109.215 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 39.3 m80 . . . . . 0 CA--C 1.519 -0.242 0 CA-C-O 120.86 0.362 . . . . 1.08 110.17 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.0 p -143.79 168.23 20.43 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.967 0.413 . . . . 1.78 111.541 -174.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.433 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.77 -159.01 23.18 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 110.824 -0.911 . . . . 0.16 110.824 -178.381 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.5 135.72 47.52 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 117.133 0.467 . . . . 1.04 110.176 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.499 ' HB3' ' HB3' ' A' ' 89' ' ' PHE . . . -151.68 140.78 21.22 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.043 0.386 . . . . 1.02 112.043 -177.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.734 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 87.0 mt -99.32 126.76 52.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.838 -0.43 . . . . 1.17 109.838 173.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -125.95 135.19 51.57 Favored 'General case' 0 C--O 1.215 -0.731 0 N-CA-C 108.433 -0.951 . . . . 0.43 108.433 178.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 57.98 26.04 12.97 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 122.68 0.392 . . . . 0.8 110.754 -177.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm 69.46 1.04 3.15 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.876 0.695 . . . . 2.57 112.876 -177.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.6 p -92.54 120.81 42.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 108.55 -0.907 . . . . 1.1 108.55 168.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.437 ' HA ' HG12 ' A' ' 8' ' ' ILE . 16.2 p -74.84 143.14 44.05 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.749 -0.66 . . . . 1.5 111.266 -174.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.82 -158.59 9.79 Favored Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.461 -0.876 . . . . 0.12 113.436 -177.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.409 HG21 ' O ' ' A' ' 5' ' ' GLY . 20.4 mm -127.78 132.6 68.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 C-N-CA 123.396 0.679 . . . . 1.02 109.362 -176.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.407 HD11 HD12 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -101.61 135.41 38.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.903 -0.406 . . . . 1.05 109.903 -176.708 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.15 130.21 28.62 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.499 0.19 . . . . 1.04 111.433 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.413 HD11 ' HB ' ' A' ' 103' ' ' THR . 53.8 mt -85.35 136.47 22.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.365 0.603 . . . . 1.04 109.921 175.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -108.47 99.7 9.06 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.935 -1.03 . . . . 1.98 111.038 -173.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.499 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 23.8 mt-10 -112.31 171.14 7.69 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.421 -0.955 . . . . 1.2 108.421 174.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 33.7 t70 79.68 -6.37 1.8 Allowed 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 122.44 1.114 . . . . 0.58 109.499 -177.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.67 HG22 ' O ' ' A' ' 23' ' ' SER . 23.4 m -103.53 -171.44 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 113.76 -1.564 . . . . 1.05 109.943 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.67 ' O ' HG22 ' A' ' 22' ' ' VAL . 60.2 p -72.02 168.62 21.24 Favored Pre-proline 0 C--N 1.319 -0.737 0 N-CA-C 105.31 -2.107 . . . . 1.77 105.31 174.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . 0.421 ' O ' HG11 ' A' ' 41' ' ' VAL . 72.8 Cg_exo -41.17 128.4 3.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 CA-C-N 121.594 1.605 . . . . 0.19 112.511 -146.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.462 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -49.2 139.9 10.41 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 114.195 -1.366 . . . . 1.03 112.482 -164.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -121.69 168.96 11.19 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 114.687 -1.142 . . . . 0.32 111.375 -170.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.492 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.99 107.02 13.54 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 107.141 -1.429 . . . . 1.02 107.141 170.258 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.559 HG22 ' OG1' ' A' ' 39' ' ' THR . 3.3 m -103.84 106.51 17.04 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-O 120.795 0.331 . . . . 1.02 110.875 -174.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.5 t90 -85.76 129.56 34.79 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 108.853 -0.795 . . . . 0.17 108.853 172.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.448 ' HG2' HG21 ' A' ' 37' ' ' VAL . 97.9 mtt180 -124.97 157.43 36.12 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.871 -0.789 . . . . 2.24 108.871 174.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -69.84 176.26 3.78 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.849 -0.426 . . . . 0.63 109.849 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.2 p -61.45 -30.58 70.67 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.237 -0.585 . . . . 0.96 111.258 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -94.94 -20.25 19.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.494 0.664 . . . . 2.12 109.626 171.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.407 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 84.7 17.15 64.31 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 114.824 -1.08 . . . . 0.23 112.635 177.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -67.38 -51.07 56.44 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.191 -0.67 . . . . 1.73 109.191 173.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -78.84 139.09 38.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.892 -0.781 . . . . 1.91 108.892 173.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.448 HG21 ' HG2' ' A' ' 30' ' ' ARG . 14.7 p -149.14 136.23 13.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 120.913 0.387 . . . . 1.04 110.739 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -144.2 127.0 16.25 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.77 -0.456 . . . . 0.54 109.77 177.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.559 ' OG1' HG22 ' A' ' 28' ' ' THR . 31.4 m -117.63 132.93 56.43 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.406 0.521 . . . . 1.04 112.406 -172.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -99.88 129.45 50.49 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 107.93 -1.137 . . . . 1.04 107.93 168.422 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.421 HG11 ' O ' ' A' ' 24' ' ' PRO . 93.3 t -93.25 121.59 44.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 O-C-N 121.044 -1.035 . . . . 1.02 108.544 172.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.6 mm? -67.37 -21.24 65.62 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.32 0.859 . . . . 1.01 113.32 -169.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.1 p -69.37 -13.74 62.53 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.223 -0.591 . . . . 1.07 109.673 175.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . 0.422 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 3.8 p -110.75 11.79 22.55 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.384 -0.826 . . . . 1.03 109.785 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.447 HD12 ' HA2' ' A' ' 64' ' ' GLY . 26.6 mm -110.75 140.76 28.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.071 -0.714 . . . . 1.01 109.071 177.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -104.8 -41.73 5.56 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.344 -0.389 . . . . 0.52 110.934 -177.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.481 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 9.7 mtmm -140.82 171.73 13.68 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.768 0.318 . . . . 1.95 111.247 -177.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.512 HD13 ' HG2' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -150.45 146.48 26.68 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.518 -0.919 . . . . 1.39 108.518 177.622 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.492 ' HG3' HD11 ' A' ' 63' ' ' ILE . 0.5 OUTLIER -142.68 120.96 12.28 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 121.211 -0.195 . . . . 2.02 110.943 -174.298 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.465 ' HB3' ' SD ' ' A' ' 97' ' ' MET . . . -117.2 152.16 35.37 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.9 -0.5 . . . . 1.05 111.467 -179.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.553 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 70.5 p -77.64 119.53 77.78 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.884 -0.598 . . . . 1.05 110.786 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.55 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 9.9 Cg_exo -60.7 165.47 11.63 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 122.711 2.274 . . . . 0.44 112.015 175.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.77 -21.29 63.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.146 0.498 . . . . 1.21 110.692 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 70.6 m -78.91 -16.94 56.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.758 -0.655 . . . . 1.94 110.961 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.55 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 30.1 m -77.32 142.07 39.59 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.802 0.811 . . . . 1.13 112.512 -177.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -55.4 -30.63 60.76 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 113.921 -1.49 . . . . 1.77 110.93 172.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -93.27 156.2 16.96 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 114.025 -1.443 . . . . 2.18 111.966 -173.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.553 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 73.6 mmm -132.52 98.66 4.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.464 -0.789 . . . . 1.11 109.206 168.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.486 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.0 OUTLIER -158.18 159.49 36.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.573 -0.74 . . . . 1.05 111.395 -170.286 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.582 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.5 tt -134.81 120.14 19.01 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.819 -0.808 . . . . 1.05 108.819 177.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.447 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 1.9 mtp180 -105.33 146.46 29.35 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.1 0.476 . . . . 3.5 111.787 -176.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.524 HD23 HD12 ' A' ' 104' ' ' LEU . 1.1 mm? -127.4 114.67 17.83 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.088 -0.96 . . . . 1.03 109.648 -177.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.603 ' N ' HD13 ' A' ' 63' ' ' ILE . 1.8 mp -90.74 102.26 13.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 120.936 0.398 . . . . 1.11 110.826 -172.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.447 ' HA2' HD12 ' A' ' 45' ' ' ILE . . . -70.56 137.0 26.79 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.732 -0.667 . . . . 0.54 111.972 178.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.422 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 90.5 mttt . . . . . 0 C--N 1.319 -0.74 0 CA-C-O 121.305 0.574 . . . . 1.08 112.39 -175.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 . . . . . 0 N--CA 1.449 -0.498 0 N-CA-C 109.416 -0.587 . . . . 3.23 109.416 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -76.14 -2.47 31.19 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.275 0.559 . . . . 2.39 110.465 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 p -92.13 2.2 56.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.692 -0.686 . . . . 3.2 109.952 172.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 4.3 ptmm? -90.57 20.56 4.52 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.588 -0.733 . . . . 2.95 110.285 -178.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.2 mtmt -40.95 114.9 0.52 Allowed 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.765 0.793 . . . . 3.72 111.031 -158.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.568 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 78.3 ttt180 -88.38 163.93 15.77 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.345 -1.298 . . . . 4.12 109.131 -168.164 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 93.4 mttt -129.49 143.1 50.69 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.287 -0.634 . . . . 4.59 109.287 172.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 40.5 p30 -82.25 -167.43 1.57 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.301 -0.409 . . . . 4.41 110.766 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -69.42 -20.47 63.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.776 0.322 . . . . 5.69 111.56 -177.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.532 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 17.0 mt-10 -89.12 -28.17 20.25 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.039 0.447 . . . . 5.38 109.966 -178.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 109.89 16.99 10.01 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.97 -0.633 . . . . 4.47 111.912 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.532 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 45.0 m-80 -78.46 138.94 38.71 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.51 -0.552 . . . . 4.72 109.51 178.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -70.15 102.03 1.99 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.29 -0.633 . . . . 4.28 109.29 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.568 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 15.8 m -113.43 98.69 7.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-O 121.791 0.805 . . . . 3.51 109.281 177.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.0 p -92.1 112.81 56.81 Favored Pre-proline 0 C--N 1.315 -0.903 0 CA-C-O 121.256 0.551 . . . . 2.87 110.154 -177.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.502 ' HG2' ' HD3' ' A' ' 70' ' ' LYS . 87.9 Cg_exo . . . . . 0 CA--C 1.518 -0.318 0 C-N-CA 123.683 2.922 . . . . 2.06 112.985 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.447 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 85.7 m-70 . . . . . 0 C--O 1.222 -0.372 0 N-CA-C 108.082 -1.081 . . . . 0.72 108.082 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.486 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 28.0 ttm -141.02 140.16 34.26 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 118.278 0.49 . . . . 1.07 110.586 174.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.499 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 13.4 m-85 -125.38 158.53 34.06 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 108.468 -0.938 . . . . 0.27 108.468 171.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.734 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 5.2 p -99.12 160.42 14.28 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 109.136 -0.69 . . . . 1.68 109.136 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . 0.582 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 38.5 m-85 -145.87 162.82 36.86 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.156 0.503 . . . . 0.32 111.746 176.056 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -123.08 0.5 9.08 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.486 -0.779 . . . . 2.7 109.836 174.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -146.85 126.82 13.63 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.661 -0.7 . . . . 1.16 109.922 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.598 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.8 mmm180 -66.26 -38.59 88.19 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.184 -0.462 . . . . 3.7 111.584 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.3 m -62.45 -24.22 67.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.05 0.453 . . . . 1.13 110.505 -175.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.611 ' O ' HG12 ' A' ' 100' ' ' ILE . 11.9 t -76.14 -59.58 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 N-CA-C 109.537 -0.542 . . . . 1.06 109.537 173.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.598 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.2 ptp -58.23 -41.78 84.86 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.602 -0.272 . . . . 1.02 111.161 -176.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.51 ' N ' ' HG3' ' A' ' 97' ' ' MET . 32.4 t70 -60.61 -40.81 93.2 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.097 -0.641 . . . . 0.34 110.39 177.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 14.0 m-20 -74.12 -40.91 62.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.177 -0.465 . . . . 1.58 111.744 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.611 HG12 ' O ' ' A' ' 96' ' ' VAL . 34.4 mm -61.08 -56.96 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.333 0 N-CA-C 108.51 -0.922 . . . . 1.01 108.51 175.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.5 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 30.0 ttpt -50.96 -50.17 58.62 Favored 'General case' 0 C--O 1.216 -0.674 0 O-C-N 124.033 0.833 . . . . 1.47 109.72 177.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.484 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.5 ttp -49.91 -55.31 14.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.757 -0.656 . . . . 1.02 111.273 178.212 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.721 ' O ' HG13 ' A' ' 107' ' ' ILE . 53.6 m -57.44 -54.58 45.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.136 -0.484 . . . . 1.04 110.353 178.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 26.8 mt -46.97 -56.13 6.94 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 123.333 0.653 . . . . 1.04 110.714 176.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.512 ' HG2' HD13 ' A' ' 48' ' ' LEU . 46.6 mt-30 -49.47 -47.43 48.45 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.693 -1.139 . . . . 1.96 112.032 177.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 102' ' ' MET . 15.9 mm100 -65.99 -36.78 84.23 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.786 0.803 . . . . 3.11 109.903 -177.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.721 HG13 ' O ' ' A' ' 103' ' ' THR . 8.3 mt -69.12 -44.38 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 CA-C-N 114.526 -1.216 . . . . 1.03 110.721 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.502 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.0 mt -64.56 -43.51 96.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.188 -0.46 . . . . 1.04 111.315 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.7 t -55.05 -28.51 52.81 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.213 0.32 . . . . 1.67 111.144 -178.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 106' ' ' GLN . 91.8 mtt180 -60.5 -51.02 71.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.482 0.658 . . . . 1.99 109.671 175.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -80.88 -15.13 57.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.339 -0.846 . . . . 1.0 110.468 -179.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.488 0 N-CA-C 109.074 -0.713 . . . . 1.46 109.074 175.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' HIS . . . . . 0.562 ' HB2' ' HB ' ' A' ' 18' ' ' ILE . 22.4 p-80 . . . . . 0 CA--C 1.512 -0.507 0 CA-C-O 121.829 0.823 . . . . 1.08 109.412 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 55.0 p -160.46 148.25 16.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.09 -0.959 . . . . 1.78 110.584 171.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.433 ' O ' HG23 ' A' ' 15' ' ' ILE . . . -175.21 -153.81 10.58 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.105 -0.798 . . . . 0.16 111.105 -177.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.63 140.28 38.26 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 117.09 0.445 . . . . 1.04 110.001 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ALA . . . . . 0.428 ' HB2' ' HB3' ' A' ' 89' ' ' PHE . . . -152.04 144.36 24.02 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.071 0.462 . . . . 1.02 111.506 -178.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.512 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 81.8 mt -109.75 106.59 21.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.063 -0.517 . . . . 1.17 110.415 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -106.3 138.65 42.1 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 108.762 -0.829 . . . . 0.43 108.762 -178.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 53.66 22.17 2.96 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.912 0.485 . . . . 0.8 111.504 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt 66.97 16.84 10.44 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.906 -0.588 . . . . 2.57 111.724 -178.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.451 HG12 ' CH2' ' A' ' 29' ' ' TRP . 2.3 p -102.52 117.35 47.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 107.467 -1.309 . . . . 1.1 107.467 163.429 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -74.4 145.32 43.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.994 0.425 . . . . 1.5 111.093 -172.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -166.49 -159.38 12.17 Favored Glycine 0 N--CA 1.437 -1.299 0 C-N-CA 120.111 -1.043 . . . . 0.12 113.408 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.433 HG23 ' O ' ' A' ' 5' ' ' GLY . 14.7 mm -124.89 132.09 71.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 114.94 -0.63 . . . . 1.02 109.475 -176.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.42 HD13 HD12 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -101.24 134.16 42.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.794 -0.447 . . . . 1.05 109.794 -177.696 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.29 124.37 22.95 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.364 -0.38 . . . . 1.04 110.933 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ILE . . . . . 0.562 ' HB ' ' HB2' ' A' ' 3' ' ' HIS . 22.8 mt -84.58 127.17 40.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.385 -0.598 . . . . 1.04 109.385 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -97.7 101.87 13.48 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.864 -0.607 . . . . 1.98 110.533 -173.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -116.41 169.05 9.61 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.136 -0.69 . . . . 1.2 109.136 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.9 t70 75.92 -1.63 2.93 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 122.151 0.977 . . . . 0.58 109.971 -177.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.628 HG23 ' O ' ' A' ' 23' ' ' SER . 32.7 m -103.06 -173.89 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 114.249 -1.341 . . . . 1.05 109.848 179.223 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.628 ' O ' HG23 ' A' ' 22' ' ' VAL . 47.8 m -72.92 167.51 33.28 Favored Pre-proline 0 C--N 1.319 -0.753 0 N-CA-C 105.157 -2.164 . . . . 1.77 105.157 173.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -41.53 126.82 3.15 Favored 'Trans proline' 0 C--N 1.357 0.974 0 CA-C-N 121.413 1.54 . . . . 0.19 112.27 -140.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.435 ' HB1' HG23 ' A' ' 107' ' ' ILE . . . -51.35 140.76 16.6 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-N 114.227 -1.351 . . . . 1.03 112.371 -165.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -124.33 169.13 12.1 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 114.126 -1.397 . . . . 0.32 111.506 -169.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.532 HD21 HG12 ' A' ' 18' ' ' ILE . 3.2 tm? -117.32 104.61 11.32 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.471 -1.307 . . . . 1.02 107.471 173.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.406 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.6 m -100.07 106.16 17.88 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 120.795 -0.362 . . . . 1.02 110.593 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.451 ' CH2' HG12 ' A' ' 12' ' ' VAL . 81.6 t90 -87.07 131.48 34.11 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.697 -0.853 . . . . 0.17 108.697 171.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.464 ' HG2' HG23 ' A' ' 37' ' ' VAL . 72.3 mtt180 -126.01 158.58 34.96 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.969 -0.752 . . . . 2.24 108.969 174.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.9 p -68.42 173.11 5.2 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.789 -0.819 . . . . 0.63 108.789 177.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -56.17 -40.67 74.25 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.572 -0.451 . . . . 0.96 111.398 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -87.83 -22.91 24.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.581 0.705 . . . . 2.12 109.824 173.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.73 16.84 47.1 Favored Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 114.964 -1.016 . . . . 0.23 112.481 178.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -59.83 -51.8 68.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.293 0.568 . . . . 1.73 109.52 173.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -88.29 144.01 26.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.306 -0.861 . . . . 1.91 109.24 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' VAL . . . . . 0.464 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.6 p -149.3 138.12 15.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.806 0.336 . . . . 1.04 110.941 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -144.09 121.46 11.65 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.645 -0.502 . . . . 0.54 109.645 177.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.436 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 48.1 m -110.79 130.47 55.57 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 111.955 0.354 . . . . 1.04 111.955 -175.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.483 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -99.56 129.76 49.62 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.77 0 N-CA-C 108.253 -1.018 . . . . 1.04 108.253 169.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.415 ' O ' HG12 ' A' ' 45' ' ' ILE . 64.5 t -92.79 119.03 39.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 O-C-N 121.144 -0.973 . . . . 1.02 108.875 173.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.412 HD13 HD23 ' A' ' 104' ' ' LEU . 2.7 mm? -67.25 -16.47 64.3 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 112.47 0.545 . . . . 1.01 112.47 -171.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.529 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 96.8 p -71.66 -14.36 62.02 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.26 -0.644 . . . . 1.07 109.26 176.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.3 p -110.1 6.6 22.99 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.321 -0.854 . . . . 1.03 109.871 -179.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.505 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 27.9 mm -107.83 141.33 23.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.652 -0.704 . . . . 1.01 109.268 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -99.29 -45.42 5.88 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.249 -0.432 . . . . 0.52 110.449 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.425 ' C ' HD22 ' A' ' 48' ' ' LEU . 10.5 mtmm -141.86 174.05 10.94 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.372 0.606 . . . . 1.95 111.83 -175.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.588 ' CD2' ' HG2' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -137.56 152.59 49.6 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 107.261 -1.385 . . . . 1.39 107.261 174.488 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.525 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -144.05 118.95 9.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.298 0.499 . . . . 2.02 110.618 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.504 ' HB2' ' SD ' ' A' ' 97' ' ' MET . . . -116.67 141.57 48.02 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 122.195 -0.316 . . . . 1.05 111.444 -178.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.445 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 81.3 p -68.74 119.78 71.39 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 115.952 -0.567 . . . . 1.05 110.753 -175.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.547 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 7.7 Cg_exo -60.56 163.43 15.45 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.646 2.231 . . . . 0.44 112.125 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.01 -21.73 66.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.707 -0.679 . . . . 1.21 111.576 -177.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.9 m -96.51 6.31 48.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.009 -0.541 . . . . 1.94 110.673 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.547 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 42.7 m -89.62 145.52 25.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.009 -0.541 . . . . 1.13 110.839 174.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -53.73 -23.39 11.57 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 114.935 -1.03 . . . . 1.77 111.666 175.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.609 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 43.2 mmtm -105.2 161.53 14.19 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 114.326 -1.306 . . . . 2.18 112.397 -164.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.445 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 83.9 mmm -131.68 97.21 4.15 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.847 -1.07 . . . . 1.11 108.528 166.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.609 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.2 OUTLIER -154.14 157.37 38.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.191 0.519 . . . . 1.05 111.676 -172.99 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 97' ' ' MET . 1.7 tt -133.63 119.59 19.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.478 -0.934 . . . . 1.05 108.478 177.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.603 ' HG2' ' HB2' ' A' ' 88' ' ' MET . 8.4 mtp180 -103.88 140.88 37.06 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.219 0.533 . . . . 3.5 111.552 -178.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.614 HD21 ' CD1' ' A' ' 104' ' ' LEU . 1.8 mm? -115.36 111.52 20.97 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.935 -1.029 . . . . 1.03 109.599 176.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ILE . . . . . 0.617 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -91.71 98.35 8.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.354 -0.384 . . . . 1.11 110.519 -169.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -68.18 144.23 42.54 Favored Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.666 -0.697 . . . . 0.54 112.039 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.505 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 81.5 mttt . . . . . 0 C--N 1.315 -0.904 0 N-CA-C 113.213 0.82 . . . . 1.08 113.213 -173.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.75 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 22.7 t70 . . . . . 0 C--O 1.214 -0.784 0 N-CA-C 109.175 -0.676 . . . . 3.23 109.175 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -62.8 -6.71 3.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.621 0.6 . . . . 2.39 112.621 -170.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -77.07 -4.08 42.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.069 0.462 . . . . 3.2 110.757 172.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.75 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.0 ptmt -82.2 41.93 0.71 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.852 -0.613 . . . . 2.95 110.326 175.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.551 ' HE2' ' OE1' ' A' ' 79' ' ' GLU . 23.5 mmtm -44.49 115.11 0.79 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.594 -0.73 . . . . 3.72 110.437 -176.295 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.653 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 77.7 ttt180 -95.68 165.87 12.1 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 107.708 -1.219 . . . . 4.12 107.708 -176.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -128.6 131.95 48.16 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 118.904 0.775 . . . . 4.59 111.215 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -73.21 172.14 11.68 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.449 -1.25 . . . . 4.41 110.236 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -51.79 -31.54 27.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.955 0.407 . . . . 5.69 111.405 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -94.18 15.87 16.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.38 -0.373 . . . . 5.38 111.694 -176.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.51 11.77 80.18 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.348 -0.387 . . . . 4.47 113.016 176.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -73.51 131.9 42.28 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.244 -0.651 . . . . 4.72 109.244 176.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLU . . . . . 0.551 ' OE1' ' HE2' ' A' ' 71' ' ' LYS . 26.8 tt0 -68.09 95.28 0.55 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.61 -0.515 . . . . 4.28 109.61 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' VAL . . . . . 0.653 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 10.8 m -102.5 99.46 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 CA-C-O 121.732 0.777 . . . . 3.51 109.277 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.519 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.1 p -82.61 117.76 69.58 Favored Pre-proline 0 C--N 1.308 -1.239 0 CA-C-N 115.704 -0.68 . . . . 2.87 109.776 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . 0.524 ' HG2' ' HE2' ' A' ' 70' ' ' LYS . 52.9 Cg_exo . . . . . 0 CA--C 1.511 -0.653 0 C-N-CA 123.282 2.655 . . . . 2.06 112.725 -174.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' HIS . . . . . 0.551 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 58.2 m-70 . . . . . 0 C--O 1.218 -0.58 0 N-CA-C 108.598 -0.89 . . . . 0.72 108.598 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.603 ' HB2' ' HG2' ' A' ' 61' ' ' ARG . 20.1 ttm -108.4 122.1 46.3 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 119.736 -0.786 . . . . 1.07 111.654 -175.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.428 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 5.9 m-85 -112.08 130.75 55.78 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.035 -0.984 . . . . 0.27 109.65 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' SER . . . . . 0.512 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -80.99 151.6 28.39 Favored 'General case' 0 C--N 1.316 -0.886 0 O-C-N 122.035 -0.415 . . . . 1.68 110.526 177.122 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -133.52 174.39 10.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.231 -0.441 . . . . 0.32 111.149 -175.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -115.71 -22.16 9.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.547 -0.751 . . . . 2.7 111.032 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -141.37 142.29 33.78 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.969 0.414 . . . . 1.16 110.528 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ARG . . . . . 0.595 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.0 mmm180 -67.61 -33.22 74.54 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.581 -0.736 . . . . 3.7 111.326 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.6 m -59.9 -38.75 83.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.17 -0.468 . . . . 1.13 110.512 -175.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.558 ' O ' HG12 ' A' ' 100' ' ' ILE . 6.6 t -67.71 -56.06 14.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.19 -0.459 . . . . 1.06 109.952 177.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' MET . . . . . 0.595 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.4 ptp -60.12 -41.09 91.88 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.422 -0.354 . . . . 1.02 111.2 -177.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . 0.453 ' N ' ' HG3' ' A' ' 97' ' ' MET . 24.6 t70 -61.96 -39.04 90.78 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 120.0 -0.68 . . . . 0.34 110.534 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -72.96 -43.92 61.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.38 -0.373 . . . . 1.58 111.393 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.597 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 33.2 mm -60.49 -56.02 20.51 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 N-CA-C 108.703 -0.851 . . . . 1.01 108.703 176.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.558 ' HE3' ' NE2' ' A' ' 105' ' ' GLN . 29.4 ttpt -52.43 -48.35 65.81 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 115.403 -0.817 . . . . 1.47 109.836 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.689 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 32.3 ttp -47.56 -59.47 3.23 Favored 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 123.812 0.695 . . . . 1.02 111.099 176.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' THR . . . . . 0.775 ' O ' HG13 ' A' ' 107' ' ' ILE . 24.3 m -56.41 -50.43 71.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.939 -0.573 . . . . 1.04 110.227 -178.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.614 ' CD1' HD21 ' A' ' 62' ' ' LEU . 25.8 mt -49.0 -56.15 9.82 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 121.342 0.591 . . . . 1.04 110.232 175.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.588 ' HG2' ' CD2' ' A' ' 48' ' ' LEU . 94.0 mt-30 -52.18 -43.12 64.0 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.778 -1.101 . . . . 1.96 112.177 176.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' GLN . . . . . 0.689 ' HG3' ' O ' ' A' ' 102' ' ' MET . 22.2 mt-30 -66.07 -38.95 89.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 122.035 0.922 . . . . 3.11 109.013 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ILE . . . . . 0.775 HG13 ' O ' ' A' ' 103' ' ' THR . 7.8 mt -72.73 -45.57 56.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 114.196 -1.365 . . . . 1.03 111.531 -177.476 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ILE . . . . . 0.581 HG13 ' O ' ' A' ' 104' ' ' LEU . 19.1 mt -58.67 -44.07 89.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 112.226 0.454 . . . . 1.04 112.226 -176.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' SER . . . . . 0.65 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 12.6 t -66.49 -15.69 63.56 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.776 -0.37 . . . . 1.67 111.865 -176.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -59.42 -35.5 74.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.619 0.723 . . . . 1.99 109.129 168.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.529 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 33.7 m-85 -97.14 -16.93 20.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.905 -1.043 . . . . 1.0 110.61 -177.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LYS . . . . . 0.65 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 9.1 mmpt? . . . . . 0 C--N 1.329 -0.307 0 N-CA-C 109.155 -0.684 . . . . 1.46 109.155 172.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo . . . . . 0 N--CA 1.478 0.593 0 N-CA-C 110.604 -0.575 . . . . 2.47 110.604 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.2 t -69.89 -32.39 70.71 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.239 -0.437 . . . . 2.05 111.189 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.539 ' CD2' HG22 ' A' ' 103' ' ' THR . 76.5 m80 69.06 -10.81 0.49 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.224 0.609 . . . . 1.08 112.217 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.1 p -147.77 161.59 40.94 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 119.807 -0.757 . . . . 1.78 112.212 -177.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.436 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -177.82 -166.21 34.01 Favored Glycine 0 N--CA 1.44 -1.063 0 CA-C-N 114.803 -1.089 . . . . 0.16 110.413 -178.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.16 132.98 44.08 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 117.432 0.616 . . . . 1.04 110.241 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.454 ' HB2' ' HB3' ' A' ' 89' ' ' PHE . . . -144.58 145.51 31.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.952 0.406 . . . . 1.02 111.578 -176.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.425 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 84.4 mt -110.84 111.05 34.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.26 -0.427 . . . . 1.17 110.246 178.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -112.51 137.33 50.89 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.714 -0.847 . . . . 0.43 108.714 -178.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 57.1 23.28 8.31 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.966 0.412 . . . . 0.8 110.479 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt 68.6 6.48 5.48 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.237 -0.892 . . . . 2.57 112.741 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.5 p -94.04 122.16 45.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 108.025 -1.102 . . . . 1.1 108.025 166.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.9 p -76.21 142.49 41.47 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.896 0.379 . . . . 1.5 111.293 -173.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.446 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -160.72 -157.72 8.88 Favored Glycine 0 N--CA 1.437 -1.282 0 C-N-CA 120.325 -0.941 . . . . 0.12 113.083 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 24.6 mm -126.66 135.58 63.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.095 -0.706 . . . . 1.02 109.095 -178.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.421 HD11 HD13 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.27 135.84 40.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.972 -0.381 . . . . 1.05 109.972 -176.428 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.98 126.71 25.5 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.846 0.355 . . . . 1.04 111.642 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.531 HD12 ' HA ' ' A' ' 3' ' ' HIS . 71.0 mt -85.24 134.38 27.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.023 0.439 . . . . 1.04 109.988 177.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -105.49 102.22 11.7 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.806 -0.633 . . . . 1.98 110.847 -175.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.426 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 23.9 mt-10 -116.66 169.68 9.17 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.166 -0.679 . . . . 1.2 109.166 174.625 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.426 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 26.6 t0 77.5 -1.32 2.71 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.474 1.131 . . . . 0.58 109.513 -175.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.605 HG21 ' O ' ' A' ' 23' ' ' SER . 30.0 m -104.56 -174.67 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 113.762 -1.563 . . . . 1.05 109.766 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.605 ' O ' HG21 ' A' ' 22' ' ' VAL . 43.1 m -73.59 169.46 18.34 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 105.46 -2.052 . . . . 1.77 105.46 174.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo -41.77 128.62 3.83 Favored 'Trans proline' 0 C--N 1.359 1.08 0 CA-C-N 121.624 1.616 . . . . 0.19 112.095 -143.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.429 ' HB1' ' CG2' ' A' ' 107' ' ' ILE . . . -55.77 143.1 32.17 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 114.194 -1.367 . . . . 1.03 112.198 -161.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.99 167.83 14.77 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 114.715 -1.129 . . . . 0.32 111.92 -170.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.492 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -118.09 107.86 14.51 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.627 -1.249 . . . . 1.02 107.627 175.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 m -102.97 106.5 17.04 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.772 0.32 . . . . 1.02 110.875 -175.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.4 t90 -87.16 131.8 34.06 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.888 -0.782 . . . . 0.17 108.888 171.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.44 ' HG2' HG21 ' A' ' 37' ' ' VAL . 60.0 mtt180 -126.36 157.88 37.31 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.918 -0.771 . . . . 2.24 108.918 174.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -67.12 172.79 4.26 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.184 -0.673 . . . . 0.63 109.184 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.446 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.2 p -57.59 -32.36 67.09 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.323 -0.551 . . . . 0.96 111.242 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -93.58 -32.18 14.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.581 0.705 . . . . 2.12 109.546 172.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.59 17.39 26.36 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 114.921 -1.036 . . . . 0.23 112.693 177.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.82 -29.37 66.63 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.269 0.557 . . . . 1.73 109.743 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -103.1 141.2 36.24 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.536 -0.912 . . . . 1.91 108.536 173.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.44 HG21 ' HG2' ' A' ' 30' ' ' ARG . 12.0 p -149.98 140.39 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.719 -0.392 . . . . 1.04 111.489 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -144.47 125.45 14.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.435 . . . . 0.54 109.969 177.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.45 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 26.4 m -111.21 133.48 53.52 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 111.876 0.324 . . . . 1.04 111.876 -175.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.08 127.73 58.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.297 -1.001 . . . . 1.04 108.297 168.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.2 t -92.25 119.19 39.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 O-C-N 121.11 -0.994 . . . . 1.02 108.863 173.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -68.28 -16.58 64.01 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.433 0.531 . . . . 1.01 112.433 -170.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.55 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 92.9 p -70.03 -14.8 62.85 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.32 -0.622 . . . . 1.07 109.32 175.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.3 p -112.76 11.13 19.33 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.103 -0.953 . . . . 1.03 110.188 -178.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.536 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 26.7 mm -108.13 139.84 28.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.5 -0.555 . . . . 1.01 109.5 178.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -102.13 -43.83 5.62 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.194 -0.457 . . . . 0.52 110.604 -177.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.1 mtmm -139.58 171.75 13.79 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.069 0.461 . . . . 1.95 110.867 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.477 ' CD2' ' HB3' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -150.31 151.95 33.71 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.383 -0.969 . . . . 1.39 108.383 178.482 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.457 ' HG3' HD13 ' A' ' 63' ' ' ILE . 2.3 mt-30 -139.02 145.98 40.3 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 109.777 -0.453 . . . . 2.02 109.777 -177.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.494 ' HB1' ' HD3' ' A' ' 101' ' ' LYS . . . -137.74 132.81 33.32 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 122.09 -0.381 . . . . 1.05 110.24 174.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.474 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 64.1 p -60.18 118.62 34.85 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.74 -0.664 . . . . 1.05 110.803 -176.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.466 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 24.6 Cg_exo -54.61 159.75 8.25 Favored 'Trans proline' 0 N--CA 1.464 -0.214 0 C-N-CA 122.776 2.318 . . . . 0.44 112.191 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.82 -21.27 66.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.011 -0.54 . . . . 1.21 111.007 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.2 p -83.42 -16.72 44.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.964 -0.562 . . . . 1.94 111.05 176.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.466 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 56.0 m -77.3 134.77 38.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.919 -0.582 . . . . 1.13 111.323 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -56.53 -32.84 65.49 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 114.999 -1.0 . . . . 1.77 110.11 172.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.43 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 35.7 mmtm -75.62 151.67 37.77 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.367 -1.288 . . . . 2.18 111.471 -176.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.474 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 5.3 mtp -131.31 98.76 4.63 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.257 -0.883 . . . . 1.11 109.454 169.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.469 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.3 OUTLIER -158.02 158.06 34.13 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.485 -0.78 . . . . 1.05 111.38 -171.613 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.436 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.4 tt -133.31 119.6 19.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.873 -1.058 . . . . 1.05 108.2 176.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.566 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.8 mtp180 -103.13 145.68 29.55 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.273 0.559 . . . . 3.5 111.476 -178.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.509 HD22 HD11 ' A' ' 104' ' ' LEU . 1.3 mm? -127.76 107.37 9.83 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.919 -1.037 . . . . 1.03 108.992 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.544 HG13 ' HG2' ' A' ' 86' ' ' ARG . 2.3 mp -88.49 103.8 14.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.745 0.307 . . . . 1.11 110.826 -171.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.428 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -67.01 144.08 44.34 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.107 -0.497 . . . . 0.54 112.164 178.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.536 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 84.6 mttt -66.51 124.79 23.77 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.488 0.551 . . . . 1.08 112.488 -176.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.62 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.3 t -119.42 132.73 68.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 115.239 -0.891 . . . . 2.32 110.415 173.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.847 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 10.4 t70 -81.98 105.02 12.76 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 114.319 -1.31 . . . . 3.23 109.107 174.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -87.52 -2.62 58.74 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.021 0.378 . . . . 2.39 112.021 -175.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.2 p -68.76 -18.24 64.18 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.573 0.701 . . . . 3.2 109.612 175.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.847 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 2.7 ptpp? -84.16 35.3 0.53 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.196 -0.911 . . . . 2.95 110.943 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -45.16 115.07 0.83 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.413 0.625 . . . . 3.72 110.139 -176.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.544 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 78.1 ttt180 -90.48 159.25 16.62 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.884 -1.053 . . . . 4.12 108.664 -171.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mtpt -124.74 131.34 53.46 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 119.824 -0.75 . . . . 4.59 110.637 174.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.9 167.5 4.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.765 -1.107 . . . . 4.41 110.692 177.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -55.15 -32.86 62.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.756 0.312 . . . . 5.69 111.31 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 12.9 mm-40 -86.98 11.98 12.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.962 0.411 . . . . 5.38 111.537 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.17 32.0 65.95 Favored Glycine 0 N--CA 1.452 -0.287 0 CA-C-N 115.972 -0.558 . . . . 4.47 113.051 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.503 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 60.9 m-80 -89.52 130.61 35.82 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.23 -0.656 . . . . 4.72 109.23 174.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -64.51 104.2 0.76 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.569 -0.53 . . . . 4.28 109.569 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.544 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 7.4 m -120.63 97.91 5.56 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 122.022 0.915 . . . . 3.51 109.518 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.42 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 p -90.42 126.71 55.55 Favored Pre-proline 0 C--N 1.31 -1.13 0 CA-C-N 115.339 -0.846 . . . . 2.87 110.195 -175.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.435 ' HG2' ' CD ' ' A' ' 70' ' ' LYS . 78.4 Cg_exo -53.43 136.03 62.37 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.993 2.462 . . . . 2.06 112.449 -176.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.461 ' HD3' ' N ' ' A' ' 83' ' ' LYS . 2.4 mppt? -95.44 146.09 30.7 Favored Pre-proline 0 C--N 1.314 -0.961 0 CA-C-N 115.552 -0.749 . . . . 3.13 109.108 178.145 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.62 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 23.5 Cg_exo -59.35 144.3 99.45 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.342 2.028 . . . . 0.99 111.272 179.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -86.81 115.28 24.13 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.683 0.754 . . . . 2.11 109.826 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.544 ' HG2' HG13 ' A' ' 63' ' ' ILE . 61.2 mtt180 -104.07 125.71 50.62 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 114.959 -1.019 . . . . 3.17 111.172 -170.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.557 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 82.0 m-70 -93.43 144.85 24.95 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 107.088 -1.449 . . . . 0.72 107.088 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.566 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 19.9 ttm -140.99 124.21 16.52 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 118.904 0.775 . . . . 1.07 111.067 176.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.454 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 6.4 m-85 -113.94 128.17 56.28 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.227 -0.897 . . . . 0.27 109.641 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.459 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.6 OUTLIER -80.4 152.27 28.94 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.925 -0.398 . . . . 1.68 109.925 177.732 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.436 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 19.9 m-85 -133.55 171.94 13.42 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.298 0.571 . . . . 0.32 111.835 -173.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -122.73 -8.03 8.48 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.035 -0.984 . . . . 2.7 110.894 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -146.01 128.31 15.81 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.213 0.53 . . . . 1.16 110.777 -176.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.419 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 8.6 mmm180 -63.24 -38.58 91.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.105 -0.952 . . . . 3.7 112.183 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 86.8 m -60.98 -36.3 79.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.816 0.341 . . . . 1.13 110.739 -178.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.605 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.0 t -67.41 -55.17 18.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.367 -0.379 . . . . 1.06 110.471 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.432 ' HA ' HD13 ' A' ' 60' ' ' LEU . 12.3 ptp -60.39 -36.54 78.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 1.02 111.128 -176.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.434 ' O ' ' HB2' ' A' ' 102' ' ' MET . 23.2 t70 -66.96 -42.96 84.29 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.544 -0.463 . . . . 0.34 110.132 177.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.442 ' O ' ' HB3' ' A' ' 102' ' ' MET . 1.5 t-20 -67.2 -44.95 78.33 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.437 0.46 . . . . 1.58 111.185 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.605 HG12 ' O ' ' A' ' 96' ' ' VAL . 33.6 mm -61.44 -56.36 18.32 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 109.412 -0.588 . . . . 1.01 109.412 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.494 ' HD3' ' HB1' ' A' ' 50' ' ' ALA . 18.9 ttpp -52.72 -44.57 66.44 Favored 'General case' 0 C--O 1.216 -0.678 0 O-C-N 123.529 0.518 . . . . 1.47 110.028 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.507 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 40.1 ttp -51.34 -54.17 28.93 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.075 -0.966 . . . . 1.02 111.24 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.747 ' O ' HG13 ' A' ' 107' ' ' ILE . 99.0 m -62.94 -51.31 67.41 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.419 -0.355 . . . . 1.04 110.877 178.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.565 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 29.5 mt -46.68 -53.52 11.51 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.728 0.775 . . . . 1.04 110.514 175.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.434 ' CG ' HD12 ' A' ' 48' ' ' LEU . 23.0 mt-30 -54.84 -41.96 71.36 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.366 -1.288 . . . . 1.96 112.345 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 102' ' ' MET . 14.7 mm100 -64.19 -33.65 76.29 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.915 0.864 . . . . 3.11 109.841 178.078 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.747 HG13 ' O ' ' A' ' 103' ' ' THR . 14.9 mt -76.59 -46.16 31.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.25 -1.341 . . . . 1.03 111.426 -177.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.8 mt -62.31 -41.39 91.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.312 -0.404 . . . . 1.04 111.976 -176.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.1 t -57.79 -25.58 60.75 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.711 0.291 . . . . 1.67 111.028 -177.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 76.9 mtt180 -64.78 -39.8 94.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.368 0.604 . . . . 1.99 109.879 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.55 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 32.5 m-85 -93.84 -10.17 34.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.193 -179.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.411 ' HE2' ' HA ' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -71.46 -34.73 70.48 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.523 -0.917 . . . . 1.46 108.523 174.627 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.03 -39.89 63.26 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 115.325 -0.852 . . . . 2.27 109.577 172.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -90.47 49.46 1.68 Allowed 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.115 -0.948 . . . . 1.47 110.731 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.1 t70 . . . . . 0 C--O 1.248 0.978 0 CA-C-N 115.456 -0.793 . . . . 2.72 110.656 -179.161 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.711 0 N-CA-C 112.071 -0.411 . . . . 20.26 112.071 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 24.7 t 55.22 76.08 0.54 Allowed Pre-proline 0 C--O 1.234 0.261 0 C-N-CA 122.82 0.448 . . . . 18.54 111.077 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -64.37 -25.27 63.93 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.785 2.323 . . . . 17.79 112.408 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -118.63 157.75 15.1 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.867 -0.682 . . . . 16.44 111.648 178.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 44.2 p90 -162.66 133.8 3.71 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.869 0.366 . . . . 16.12 110.503 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.39 -158.4 0.09 OUTLIER 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.97 2.447 . . . . 13.81 112.271 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -59.21 -56.51 21.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.51 -0.314 . . . . 12.88 111.085 -179.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 169.13 95.31 0.1 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 119.936 -1.126 . . . . 9.73 113.117 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.6 29.54 6.23 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.407 0.623 . . . . 8.74 110.311 173.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 99.1 mt -67.81 -8.7 38.16 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.382 -0.826 . . . . 10.79 111.88 -176.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 29.4 t -99.13 -49.99 4.31 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.085 -0.507 . . . . 7.62 109.633 177.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 99.45 11.35 44.99 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.86 -0.686 . . . . 5.26 112.473 173.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -114.89 -4.88 12.58 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.784 0.802 . . . . 5.5 109.331 -176.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 48.5 mp0 -74.09 -13.43 60.83 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 114.477 -1.238 . . . . 5.68 110.365 179.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -86.9 -11.0 51.99 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 113.69 -1.596 . . . . 3.22 110.338 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -77.47 -3.01 38.25 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.229 0.537 . . . . 5.14 110.498 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 11.1 p -68.13 -12.63 61.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.745 -0.661 . . . . 1.34 109.835 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 536' ' ' SER . . . . . 0.51 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 79.5 p -74.46 -33.85 63.01 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.549 -0.751 . . . . 2.43 110.053 175.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 27.5 mm -80.72 -37.65 16.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.883 -0.599 . . . . 1.69 110.059 175.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -73.43 1.02 10.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.772 0.796 . . . . 1.36 110.533 175.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.51 ' HB3' ' O ' ' B' ' 536' ' ' SER . 14.1 t70 -84.84 -44.74 12.96 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.796 -1.093 . . . . 1.23 109.431 172.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 13.9 tmm? -59.13 -39.53 82.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.003 -0.999 . . . . 2.83 109.113 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . 0.463 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 3.6 t70 -51.61 -51.23 57.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.909 -1.041 . . . . 1.18 110.423 175.29 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.57 -41.22 93.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.174 -0.921 . . . . 0.66 111.25 -174.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 9.1 t -60.78 -35.67 77.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.901 -0.59 . . . . 2.08 110.18 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -71.9 -35.34 69.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.932 -0.576 . . . . 1.34 111.061 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 94.7 mt -65.58 -44.47 86.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.028 -0.533 . . . . 1.82 111.875 -176.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 48.0 mt -69.67 -25.94 64.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.219 0.533 . . . . 1.54 110.398 -179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 50.8 p -90.14 13.49 14.95 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.656 -0.702 . . . . 1.92 111.554 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -78.21 -1.32 32.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.66 0.266 . . . . 3.31 110.69 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 65.7 mt 71.87 -62.75 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 115.493 -0.776 . . . . 5.68 110.314 -177.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.9 m -69.57 139.14 53.68 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.761 -0.459 . . . . 6.4 109.761 175.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 39.8 m . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.649 -0.691 . . . . 7.59 110.505 179.908 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo . . . . . 0 N--CA 1.479 0.63 0 N-CA-C 110.849 -0.481 . . . . 2.47 110.849 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 38.4 t -69.16 -32.73 72.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.957 -0.565 . . . . 2.05 110.735 -178.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 68.6 m80 70.44 -12.45 0.52 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.881 0.696 . . . . 1.08 112.881 177.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 p -146.53 167.24 24.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.647 0.737 . . . . 1.78 112.962 -172.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.478 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 176.01 -165.97 36.86 Favored Glycine 0 N--CA 1.445 -0.761 0 CA-C-N 114.511 -1.222 . . . . 0.16 110.049 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.81 135.69 38.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 118.017 0.908 . . . . 1.04 110.461 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.54 146.71 32.51 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.014 0.435 . . . . 1.02 111.111 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.513 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 52.2 mt -110.38 111.06 34.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.911 -0.586 . . . . 1.17 110.054 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -112.57 132.32 55.18 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 108.598 -0.89 . . . . 0.43 108.598 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 58.51 25.2 12.76 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 120.962 0.411 . . . . 0.8 110.539 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.7 mtpt 68.98 4.12 4.36 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.551 -0.75 . . . . 2.57 112.901 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.41 ' O ' ' HZ2' ' A' ' 29' ' ' TRP . 1.2 p -92.37 115.25 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 107.697 -1.224 . . . . 1.1 107.697 166.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.0 m -71.92 145.75 48.28 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.057 -0.52 . . . . 1.5 110.82 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.73 -158.76 10.57 Favored Glycine 0 N--CA 1.433 -1.538 0 C-N-CA 119.914 -1.136 . . . . 0.12 113.196 -177.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.7 mm -126.18 132.03 70.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 109.336 -0.616 . . . . 1.02 109.336 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.403 HD12 HD12 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -100.49 134.93 38.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.721 -0.474 . . . . 1.05 109.721 -177.559 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.11 128.18 27.7 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.416 -0.356 . . . . 1.04 111.054 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.2 mt -85.1 138.07 19.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.387 0.613 . . . . 1.04 109.932 175.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -106.93 99.4 8.97 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 114.808 -1.087 . . . . 1.98 110.299 -176.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -113.97 169.71 8.8 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.317 -0.623 . . . . 1.2 109.317 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.2 t70 76.16 -2.1 2.81 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 122.107 0.956 . . . . 0.58 109.857 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 23' ' ' SER . 34.6 m -103.2 -173.59 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.156 -1.384 . . . . 1.05 109.742 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.618 ' O ' HG22 ' A' ' 22' ' ' VAL . 28.4 m -72.68 167.31 34.57 Favored Pre-proline 0 C--N 1.318 -0.79 0 N-CA-C 105.065 -2.198 . . . . 1.77 105.065 173.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -42.09 127.71 3.99 Favored 'Trans proline' 0 C--N 1.355 0.896 0 CA-C-N 121.279 1.492 . . . . 0.19 112.412 -140.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -50.53 138.57 17.34 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 113.942 -1.481 . . . . 1.03 112.399 -166.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -123.39 168.77 12.1 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 114.259 -1.337 . . . . 0.32 111.817 -170.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.489 ' HB3' HG23 ' A' ' 40' ' ' VAL . 3.1 tm? -117.15 106.5 13.4 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.324 -1.361 . . . . 1.02 107.324 172.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.3 m -102.52 106.22 16.89 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 120.887 0.375 . . . . 1.02 110.785 -176.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.41 ' HZ2' ' O ' ' A' ' 12' ' ' VAL . 81.5 t90 -85.24 132.14 34.32 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.781 -0.822 . . . . 0.17 108.781 172.391 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.439 ' HG2' HG22 ' A' ' 37' ' ' VAL . 57.1 mtt180 -125.84 158.27 35.46 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.023 -0.732 . . . . 2.24 109.023 174.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.2 p -69.84 175.99 3.96 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 109.305 -0.628 . . . . 0.63 109.305 178.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 p -59.89 -38.3 81.85 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.231 -0.588 . . . . 0.96 111.034 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.0 -29.89 24.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.776 0.798 . . . . 2.12 109.36 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 94.66 16.41 42.56 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 114.737 -1.12 . . . . 0.23 112.331 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -69.11 -40.07 78.57 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.433 -0.58 . . . . 1.73 109.433 176.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -87.89 139.42 30.53 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.799 -0.815 . . . . 1.91 108.799 171.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.439 HG22 ' HG2' ' A' ' 30' ' ' ARG . 13.6 p -149.1 137.86 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.811 0.338 . . . . 1.04 110.828 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -144.5 123.16 12.54 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.756 -0.461 . . . . 0.54 109.756 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 49.2 m -112.81 131.94 55.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.732 0.641 . . . . 1.04 112.732 -174.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.489 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -99.31 131.03 47.38 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.597 0 N-CA-C 108.035 -1.098 . . . . 1.04 108.035 168.259 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.406 ' O ' HG12 ' A' ' 45' ' ' ILE . 63.9 t -93.86 121.38 44.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 O-C-N 121.122 -0.986 . . . . 1.02 108.843 171.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.425 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -68.61 -19.77 64.46 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.157 0.799 . . . . 1.01 113.157 -169.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.3 p -69.43 -14.44 62.89 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.05 -0.66 . . . . 1.07 109.681 175.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -109.62 10.54 24.96 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.599 -0.728 . . . . 1.03 110.076 -178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.454 ' HA ' ' HA2' ' A' ' 64' ' ' GLY . 24.6 mm -111.48 141.09 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 108.871 -0.788 . . . . 1.01 108.871 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -106.91 -43.67 4.6 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.908 0.385 . . . . 0.52 110.636 -177.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.447 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 1.0 OUTLIER -134.31 165.81 24.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.042 -0.526 . . . . 1.95 110.744 -174.822 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.501 HD13 HD11 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -150.32 132.35 15.26 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.706 -0.85 . . . . 1.39 108.706 177.816 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -134.91 123.11 22.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.969 -0.382 . . . . 2.02 109.969 -172.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -115.93 143.15 45.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.321 0.509 . . . . 1.05 110.907 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.592 ' HB ' ' OG ' ' A' ' 55' ' ' SER . 62.0 p -61.73 120.78 59.72 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 115.884 -0.598 . . . . 1.05 110.859 -177.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.418 ' HD2' ' HB3' ' A' ' 55' ' ' SER . 24.6 Cg_exo -55.29 157.11 15.0 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.556 2.17 . . . . 0.44 111.445 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.23 -9.03 14.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.854 0.359 . . . . 1.21 111.854 -177.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.9 p -104.76 -9.46 18.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 1.94 111.829 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.592 ' OG ' ' HB ' ' A' ' 51' ' ' THR . 89.5 p -64.83 151.89 44.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.062 0.458 . . . . 1.13 111.092 -178.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.436 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 65.4 mt-10 -59.2 -22.7 61.43 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.823 0.82 . . . . 1.77 110.231 171.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.525 ' HB3' HG22 ' A' ' 51' ' ' THR . 9.9 mptt -101.43 169.42 8.88 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 114.27 -1.332 . . . . 2.18 112.838 -170.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.46 ' O ' ' HG3' ' A' ' 59' ' ' MET . 65.7 mmm -141.44 98.34 3.34 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.474 -1.239 . . . . 1.11 108.109 165.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.512 ' HE3' ' SD ' ' A' ' 88' ' ' MET . 0.0 OUTLIER -157.52 160.31 38.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.685 -0.689 . . . . 1.05 111.346 -169.733 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.482 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.4 tt -131.99 120.38 22.37 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.046 -0.979 . . . . 1.05 108.481 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.528 HH22 ' HB2' ' B' ' 539' ' ' ASP . 3.6 mmt85 -99.95 131.62 45.8 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 120.992 0.425 . . . . 3.5 110.37 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.549 HD23 HD11 ' A' ' 104' ' ' LEU . 1.4 mm? -112.84 106.44 14.76 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.563 -0.744 . . . . 1.03 109.0 175.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.447 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 4.7 mp -92.32 105.7 16.97 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 120.955 0.407 . . . . 1.11 111.163 -171.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.511 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -63.04 164.36 28.29 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.356 -0.838 . . . . 0.54 112.626 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.401 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.7 mttt -81.72 120.09 24.68 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.567 0.699 . . . . 1.08 112.567 -176.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.625 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.4 t -120.7 138.48 51.03 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 114.555 -1.202 . . . . 2.32 109.471 170.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.806 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 22.1 t70 -87.38 84.86 7.13 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 109.292 -0.632 . . . . 3.23 109.292 178.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.4 -2.65 6.58 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.109 0.411 . . . . 2.39 112.109 -172.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.9 p -80.18 -0.99 38.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.934 0.397 . . . . 3.2 110.716 171.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.806 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.4 ptpt -86.85 39.05 0.83 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.112 -0.495 . . . . 2.95 110.154 173.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.523 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 24.7 mmtm -43.71 113.81 0.56 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.982 -0.554 . . . . 3.72 110.366 -175.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.641 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 56.8 ttt180 -90.71 161.53 15.31 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.075 -1.083 . . . . 4.12 108.075 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 95.7 mttt -135.29 144.97 47.06 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 118.188 0.449 . . . . 4.59 110.053 175.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.457 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER -78.88 179.92 6.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.933 -0.576 . . . . 4.41 109.559 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -56.33 -29.76 61.73 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 111.913 0.338 . . . . 5.69 111.913 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.457 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 17.6 mt-10 -81.22 -40.83 23.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.855 0.359 . . . . 5.38 110.83 -178.638 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.22 15.47 2.05 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.427 -0.892 . . . . 4.47 112.835 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.527 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 41.0 m-80 -74.04 132.07 41.98 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.664 -0.495 . . . . 4.72 109.664 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -74.48 92.93 2.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.127 0.489 . . . . 4.28 110.028 -178.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.641 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 7.5 m -102.65 99.46 8.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.833 0.825 . . . . 3.51 109.227 -179.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.523 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.85 125.57 62.25 Favored Pre-proline 0 C--N 1.312 -1.051 0 CA-C-N 115.886 -0.597 . . . . 2.87 110.492 -176.279 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -59.76 140.06 91.52 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.852 2.368 . . . . 2.06 111.998 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -94.91 144.02 27.13 Favored Pre-proline 0 C--N 1.314 -0.964 0 CA-C-N 115.672 -0.694 . . . . 3.13 109.501 178.71 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.625 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 24.6 Cg_exo -60.51 150.72 79.87 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.76 2.307 . . . . 0.99 111.135 178.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -81.06 113.79 19.49 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.296 0.57 . . . . 2.11 109.547 -175.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.435 ' HA ' ' HA ' ' A' ' 63' ' ' ILE . 87.5 mtt180 -101.3 115.82 31.39 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.498 -0.774 . . . . 3.17 110.535 -172.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.446 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 40.3 m-70 -94.56 112.04 23.8 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.258 -0.883 . . . . 0.72 109.348 -173.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.523 ' CB ' ' HD3' ' A' ' 61' ' ' ARG . 23.2 ttm -101.92 132.82 47.49 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.374 -0.53 . . . . 1.07 111.261 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -121.66 129.64 52.92 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.252 -0.648 . . . . 0.27 109.252 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.513 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -80.69 153.6 27.79 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 120.943 0.401 . . . . 1.68 110.186 176.687 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.482 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 21.2 m-85 -135.75 166.07 24.12 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.298 0.571 . . . . 0.32 111.195 -175.17 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -114.61 -19.32 11.16 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.198 -0.91 . . . . 2.7 109.869 176.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.425 ' HB2' HG23 ' A' ' 96' ' ' VAL . 18.7 m120 -134.89 123.66 23.79 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.884 -0.598 . . . . 1.16 110.788 -174.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.519 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 14.6 mmm180 -63.04 -34.25 77.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.337 -0.847 . . . . 3.7 112.236 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.4 m -62.16 -34.62 76.74 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.955 0.407 . . . . 1.13 110.777 -178.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.2 t -70.13 -58.01 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-N 116.03 -0.532 . . . . 1.06 110.265 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.519 ' SD ' ' HD2' ' A' ' 94' ' ' ARG . 13.3 ptp -55.32 -38.42 68.69 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.15 -0.477 . . . . 1.02 111.052 -177.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.424 ' N ' ' HG3' ' A' ' 97' ' ' MET . 30.1 t70 -63.9 -45.65 88.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.647 0.261 . . . . 0.34 110.448 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -71.69 -35.25 70.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.088 -0.505 . . . . 1.58 111.887 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 96' ' ' VAL . 28.2 mm -66.95 -57.47 9.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 108.472 -0.936 . . . . 1.01 108.472 175.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 97' ' ' MET . 31.7 ttpt -48.0 -50.39 27.7 Favored 'General case' 0 C--O 1.219 -0.522 0 O-C-N 124.223 0.952 . . . . 1.47 109.899 176.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.674 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 48.1 ttp -48.19 -57.55 5.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.227 -0.897 . . . . 1.02 111.2 177.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.722 ' O ' HG13 ' A' ' 107' ' ' ILE . 45.1 m -58.45 -53.77 54.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.413 -0.358 . . . . 1.04 110.73 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.549 HD11 HD23 ' A' ' 62' ' ' LEU . 22.7 mt -47.21 -53.77 12.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.492 0.663 . . . . 1.04 110.561 176.054 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.409 HE21 ' HA ' ' A' ' 102' ' ' MET . 22.8 mt-30 -53.66 -42.04 67.45 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.611 -1.177 . . . . 1.96 112.372 176.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.674 ' HG3' ' O ' ' A' ' 102' ' ' MET . 36.8 mt-30 -66.03 -31.65 72.67 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.782 0.801 . . . . 3.11 109.194 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.722 HG13 ' O ' ' A' ' 103' ' ' THR . 15.0 mt -77.35 -45.1 29.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 114.597 -1.183 . . . . 1.03 111.289 -177.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.501 HD11 HD13 ' A' ' 48' ' ' LEU . 9.8 mt -65.24 -38.45 82.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.166 -0.47 . . . . 1.04 112.177 -175.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.8 p -59.54 -26.49 65.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.878 0.37 . . . . 1.67 110.986 -179.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -60.63 -50.58 72.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.79 0.805 . . . . 1.99 109.478 173.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.637 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 9.3 m-85 -89.96 28.31 1.4 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.71 -1.132 . . . . 1.0 110.1 177.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.415 ' HE2' ' HA ' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -117.47 -40.26 3.08 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.036 -1.098 . . . . 1.46 108.036 174.24 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -65.58 -29.98 70.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.128 -0.942 . . . . 2.27 109.117 166.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -113.29 62.69 0.64 Allowed 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 114.943 -1.026 . . . . 1.47 110.057 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.637 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 31.3 t70 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.243 -0.884 . . . . 2.72 110.428 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 112.144 -0.383 . . . . 20.26 112.144 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 32.5 m -121.56 151.05 56.24 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 109.942 -0.392 . . . . 18.54 109.942 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -77.23 47.53 2.27 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.86 2.373 . . . . 17.79 112.29 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -91.55 66.8 2.28 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 115.662 -0.699 . . . . 16.44 112.375 -177.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -150.82 130.09 6.46 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-O 120.783 0.325 . . . . 16.12 110.267 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -81.41 -11.25 11.92 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.675 2.25 . . . . 13.81 111.549 177.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . 0.437 ' O ' ' HB2' ' B' ' 528' ' ' LEU . 88.5 m-20 -86.4 67.91 10.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.446 -0.797 . . . . 12.88 110.544 -178.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -73.65 -5.93 70.09 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.96 -0.638 . . . . 9.73 112.102 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.65 14.58 30.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.068 0.461 . . . . 8.74 110.455 178.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . 0.437 ' HB2' ' O ' ' B' ' 525' ' ' ASN . 0.5 OUTLIER -79.37 47.64 0.83 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.905 -0.589 . . . . 10.79 110.62 -175.496 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 26.9 t 178.75 -58.59 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.098 -0.705 . . . . 7.62 109.098 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 68.06 79.52 0.25 Allowed Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.795 -0.717 . . . . 5.26 111.651 178.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -106.19 17.17 23.89 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.924 0.869 . . . . 5.5 108.856 -173.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -82.88 -10.04 59.02 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 114.153 -1.385 . . . . 5.68 109.774 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -112.78 -31.62 6.67 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 113.089 -1.869 . . . . 3.22 109.566 176.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -68.98 -17.32 63.92 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.444 -0.798 . . . . 5.14 110.845 178.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 5.3 p -64.49 -24.56 67.65 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.069 -0.514 . . . . 1.34 111.032 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 15.2 m -71.22 -35.86 71.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.993 -0.549 . . . . 2.43 110.661 177.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 23.0 mm -87.12 -31.62 6.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.052 -0.522 . . . . 1.69 110.359 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . 0.452 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -72.28 -1.07 13.93 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.653 0.739 . . . . 1.36 110.656 178.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.528 ' HB2' HH22 ' A' ' 61' ' ' ARG . 30.6 t70 -74.77 -38.63 62.13 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.864 -1.062 . . . . 1.23 109.239 172.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 87.3 mtp -72.86 -23.56 60.76 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.831 -1.077 . . . . 2.83 110.069 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . 0.516 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 0.2 OUTLIER -65.16 -46.91 78.93 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.431 -0.804 . . . . 1.18 110.238 174.381 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -40.98 86.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.523 -0.762 . . . . 0.66 112.081 -172.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -26.48 66.95 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.041 0.448 . . . . 2.08 111.281 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' B' ' 548' ' ' GLN . . . -85.49 -35.62 21.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.064 -0.516 . . . . 1.34 110.307 177.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . 0.568 HD21 ' NE2' ' B' ' 548' ' ' GLN . 96.3 mt -62.5 -44.09 97.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.926 -0.579 . . . . 1.82 111.785 -179.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 20.6 mt -71.6 -22.88 61.66 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.548 0.69 . . . . 1.54 110.195 -179.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 32.9 m -90.67 12.62 18.45 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.027 -0.988 . . . . 1.92 111.281 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . 0.568 ' NE2' HD21 ' B' ' 545' ' ' LEU . 68.2 mt-30 -85.92 56.36 3.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.275 0.559 . . . . 3.31 112.002 -178.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . 0.42 ' H ' HD11 ' B' ' 549' ' ' ILE . 0.2 OUTLIER -118.19 22.38 5.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.503 0.668 . . . . 5.68 109.421 171.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.4 m -82.78 73.6 9.8 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.27 -0.877 . . . . 6.4 110.463 -178.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 8.2 t . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.604 -0.712 . . . . 7.59 109.19 179.831 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.532 ' HA ' ' OD1' ' A' ' 99' ' ' ASN . 1.2 Cg_endo . . . . . 0 N--CA 1.477 0.539 0 N-CA-C 110.718 -0.532 . . . . 2.47 110.718 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.9 p -76.58 -22.11 54.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.185 -0.461 . . . . 2.05 111.477 -176.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.555 ' CD2' HG21 ' A' ' 103' ' ' THR . 73.7 m80 64.12 -0.1 0.9 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.741 -0.663 . . . . 1.08 112.033 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.9 p -157.25 155.7 31.24 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 119.943 -0.703 . . . . 1.78 112.318 -174.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.503 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -173.76 -162.17 25.14 Favored Glycine 0 N--CA 1.439 -1.124 0 CA-C-N 114.627 -1.169 . . . . 0.16 110.438 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -101.39 136.02 41.93 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 117.345 0.573 . . . . 1.04 110.162 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.462 ' HB2' ' HB3' ' A' ' 89' ' ' PHE . . . -147.45 141.15 25.63 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.988 0.423 . . . . 1.02 111.876 -176.028 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.449 HG12 ' HA ' ' A' ' 13' ' ' SER . 88.0 mt -105.58 122.26 58.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.147 -0.479 . . . . 1.17 109.937 175.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -127.79 131.2 49.62 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.723 -0.843 . . . . 0.43 108.723 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 60.28 29.62 19.16 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.909 0.484 . . . . 0.8 110.562 -177.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm 65.72 5.78 3.54 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.921 0.711 . . . . 2.57 112.921 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 p -98.49 119.91 47.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.476 -0.935 . . . . 1.1 108.476 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.449 ' HA ' HG12 ' A' ' 8' ' ' ILE . 52.5 p -74.34 144.71 44.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.158 -0.474 . . . . 1.5 110.904 -175.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.403 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.81 -159.57 10.26 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.258 -0.972 . . . . 0.12 113.286 -178.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 19.9 mm -125.93 134.73 65.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 109.107 -0.701 . . . . 1.02 109.107 -178.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.434 HD11 HD13 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.22 135.7 37.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 110.129 -0.323 . . . . 1.05 110.129 -176.572 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.59 129.03 30.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.985 0.421 . . . . 1.04 111.413 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.495 HD12 ' HA ' ' A' ' 3' ' ' HIS . 61.9 mt -85.91 135.37 25.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 109.763 -0.458 . . . . 1.04 109.763 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -108.67 103.28 12.35 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.096 -0.502 . . . . 1.98 111.182 -173.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 28.2 mt-10 -116.79 170.75 8.36 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.46 -0.941 . . . . 1.2 108.46 174.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.8 t70 81.07 -5.97 1.63 Allowed 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 122.428 1.109 . . . . 0.58 109.361 -176.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 23' ' ' SER . 32.7 m -103.33 -174.17 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 CA-C-N 113.753 -1.567 . . . . 1.05 109.943 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.645 ' O ' HG23 ' A' ' 22' ' ' VAL . 57.9 m -73.14 168.67 22.75 Favored Pre-proline 0 C--N 1.313 -1.001 0 N-CA-C 105.423 -2.066 . . . . 1.77 105.423 173.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -41.31 128.13 3.16 Favored 'Trans proline' 0 C--N 1.355 0.885 0 CA-C-N 121.296 1.499 . . . . 0.19 112.642 -143.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.437 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -51.44 141.7 15.14 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 113.993 -1.458 . . . . 1.03 112.563 -165.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.65 168.79 12.67 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 114.228 -1.351 . . . . 0.32 111.922 -170.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.49 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -116.53 107.3 14.57 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.398 -1.334 . . . . 1.02 107.398 172.173 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.6 m -104.49 106.7 17.3 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 120.878 0.371 . . . . 1.02 110.894 -175.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.7 t90 -85.12 132.34 34.32 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.842 -0.799 . . . . 0.17 108.842 172.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.461 ' HG2' HG22 ' A' ' 37' ' ' VAL . 62.1 mtt180 -127.29 156.97 41.09 Favored 'General case' 0 C--N 1.31 -1.122 0 N-CA-C 108.893 -0.781 . . . . 2.24 108.893 174.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -68.76 176.04 3.25 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.385 -0.598 . . . . 0.63 109.385 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.403 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 9.3 p -60.13 -40.79 91.02 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.162 -0.615 . . . . 0.96 110.421 178.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -76.73 -31.33 57.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.85 0.833 . . . . 2.12 109.157 170.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.405 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 89.63 15.27 58.55 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 114.458 -1.247 . . . . 0.23 111.813 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -64.36 -53.37 49.7 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.288 -0.634 . . . . 1.73 109.288 174.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.0 tttt -76.76 139.28 40.36 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.328 -0.851 . . . . 1.91 108.878 174.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.461 HG22 ' HG2' ' A' ' 30' ' ' ARG . 12.4 p -149.43 138.81 15.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.927 0.394 . . . . 1.04 111.142 -178.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -144.18 126.21 15.45 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.751 -0.463 . . . . 0.54 109.751 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.401 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 30.0 m -114.7 133.22 56.05 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.396 0.517 . . . . 1.04 112.396 -173.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.49 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -101.74 130.05 52.0 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.592 0 N-CA-C 108.125 -1.065 . . . . 1.04 108.125 168.482 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 63.3 t -93.72 121.93 44.77 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 O-C-N 121.194 -0.941 . . . . 1.02 108.801 173.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.427 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -69.35 -18.45 63.8 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.136 0.791 . . . . 1.01 113.136 -169.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.6 p -69.55 -15.47 63.23 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.922 -0.711 . . . . 1.07 109.562 174.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 p -109.84 12.2 24.03 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.464 -0.789 . . . . 1.03 110.013 -178.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.495 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 25.9 mm -111.54 138.91 38.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.991 -0.549 . . . . 1.01 109.659 178.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -100.1 -46.66 5.25 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.824 -0.625 . . . . 0.52 110.563 -177.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.478 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 18.1 mtmt -140.3 174.73 10.22 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.135 0.493 . . . . 1.95 111.442 -176.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.478 ' HG ' ' C ' ' A' ' 47' ' ' LYS . 0.1 OUTLIER -152.73 136.07 15.84 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.748 -0.834 . . . . 1.39 108.748 -179.35 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.435 HE21 HD12 ' B' ' 546' ' ' LEU . 6.8 mm100 -129.81 122.53 28.94 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 122.282 -0.261 . . . . 2.02 110.463 -175.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.436 ' C ' ' HZ ' ' B' ' 542' ' ' PHE . . . -116.09 140.97 48.74 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 122.052 -0.405 . . . . 1.05 111.279 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 66.6 p -66.97 119.3 63.03 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-N 116.099 -0.5 . . . . 1.05 110.146 -177.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.475 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 26.0 Cg_exo -54.25 159.91 7.28 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 122.721 2.28 . . . . 0.44 111.556 178.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.89 -15.69 63.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.195 -0.457 . . . . 1.21 110.573 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -86.14 -16.82 36.71 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 1.94 110.595 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.475 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 47.4 m -76.79 140.7 40.81 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.845 -0.616 . . . . 1.13 111.019 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -66.56 -18.68 65.5 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.404 -0.817 . . . . 1.77 110.7 176.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.55 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 11.2 mmmm -87.05 151.14 23.5 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.743 -1.117 . . . . 2.18 111.031 -175.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.494 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -124.93 96.57 4.92 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 108.121 -1.066 . . . . 1.11 108.121 169.139 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.55 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.23 155.96 34.77 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.458 0.647 . . . . 1.05 111.899 -174.499 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.49 HD12 ' O ' ' A' ' 97' ' ' MET . 1.6 tt -134.36 119.25 18.4 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.698 -1.137 . . . . 1.05 108.329 175.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.703 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 3.5 mtp180 -102.42 142.78 33.08 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.249 0.547 . . . . 3.5 111.311 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.518 ' HB2' ' HB2' ' A' ' 87' ' ' HIS . 1.2 mm? -121.53 107.81 12.87 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.036 -0.984 . . . . 1.03 109.012 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.654 ' N ' HD13 ' A' ' 63' ' ' ILE . 1.7 mp -90.81 103.67 14.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.773 -0.455 . . . . 1.11 109.773 -172.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.443 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -67.54 151.89 52.39 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 121.394 -0.432 . . . . 0.54 112.885 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.495 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 83.8 mttt -70.54 159.03 35.07 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 122.655 0.382 . . . . 1.08 111.182 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -106.35 109.43 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 116.293 -0.412 . . . . 2.32 110.953 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.579 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.3 m-20 -93.62 79.11 4.29 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.993 -1.114 . . . . 3.23 107.993 169.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.68 -1.79 4.18 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.31 0.485 . . . . 2.39 112.31 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.2 p -69.21 -11.26 60.65 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.35 0.595 . . . . 3.2 109.861 168.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -84.69 26.41 0.82 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.399 -0.819 . . . . 2.95 111.382 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.7 mtmt -47.08 113.75 0.73 Allowed 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.432 0.634 . . . . 3.72 109.332 -174.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.418 ' HB3' HG23 ' A' ' 80' ' ' VAL . 72.6 ttt180 -96.85 168.61 10.39 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.692 -1.14 . . . . 4.12 109.069 -167.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.542 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 63.9 mttp -133.59 141.47 47.69 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 118.104 0.411 . . . . 4.59 110.185 174.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -82.11 -168.38 1.93 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.902 -0.59 . . . . 4.41 110.695 -177.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -56.84 -31.11 64.45 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.799 0.296 . . . . 5.69 111.799 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.445 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 10.6 mt-10 -86.86 -34.68 19.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.1 0.476 . . . . 5.38 110.444 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.94 18.36 5.15 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.478 -0.868 . . . . 4.47 112.049 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.542 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 30.8 m-80 -75.39 134.8 40.86 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.993 -0.744 . . . . 4.72 108.993 177.557 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -69.02 92.68 0.53 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.982 0.42 . . . . 4.28 110.235 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.418 HG23 ' HB3' ' A' ' 72' ' ' ARG . 19.0 m -97.22 99.58 9.16 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-O 121.677 0.751 . . . . 3.51 109.574 176.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 1.5 p -85.4 107.38 12.0 Favored Pre-proline 0 C--N 1.317 -0.844 0 N-CA-C 109.354 -0.61 . . . . 2.87 109.354 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -63.8 151.6 84.43 Favored 'Trans proline' 0 C--O 1.234 0.301 0 C-N-CA 123.48 2.786 . . . . 2.06 113.943 -170.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.485 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 27.3 mtmm -87.26 172.85 7.36 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 113.991 -1.459 . . . . 3.13 108.684 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.485 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 22.9 Cg_exo -53.39 143.98 52.0 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 121.194 1.263 . . . . 0.99 111.281 176.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -92.79 113.35 25.6 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 116.201 -0.454 . . . . 2.11 109.777 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.577 ' HD2' HG13 ' A' ' 63' ' ' ILE . 0.7 OUTLIER -96.37 121.7 38.45 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 109.537 -0.542 . . . . 3.17 109.537 -176.048 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.557 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 77.8 m-70 -96.29 148.08 23.12 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 107.541 -1.281 . . . . 0.72 107.541 176.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.703 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 22.9 ttm -140.97 132.35 26.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 119.135 0.88 . . . . 1.07 111.265 173.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.462 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 8.6 m-85 -122.18 128.74 51.58 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.339 -0.846 . . . . 0.27 109.588 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.457 ' O ' ' HA ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -81.65 150.57 28.01 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.943 -0.391 . . . . 1.68 109.943 177.251 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.41 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.1 m-85 -130.13 175.73 8.67 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.965 0.412 . . . . 0.32 111.55 -173.525 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -122.57 -9.53 8.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.715 -0.675 . . . . 2.7 110.494 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.441 ' HB2' HG23 ' A' ' 96' ' ' VAL . 52.6 m-80 -146.16 136.96 24.31 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.237 -0.438 . . . . 1.16 110.087 -179.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.428 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 1.2 mpp_? -70.5 -35.09 73.03 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.905 -0.589 . . . . 3.7 111.544 -178.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.439 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 19.5 m -61.63 -36.34 80.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.801 0.334 . . . . 1.13 110.578 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.605 ' O ' HG12 ' A' ' 100' ' ' ILE . 17.5 t -64.71 -58.2 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 116.203 -0.453 . . . . 1.06 110.499 178.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.49 ' O ' HD12 ' A' ' 60' ' ' LEU . 14.0 ptp -57.59 -39.1 76.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 1.02 110.916 -177.257 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 97' ' ' MET . 19.5 t70 -65.66 -42.14 91.7 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.641 -0.424 . . . . 0.34 110.208 177.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.532 ' OD1' ' HA ' ' A' ' 1' ' ' PRO . 1.6 t-20 -68.83 -43.97 74.42 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 123.27 0.356 . . . . 1.58 111.351 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.605 HG12 ' O ' ' A' ' 96' ' ' VAL . 31.4 mm -61.8 -56.58 16.81 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 N-CA-C 108.674 -0.862 . . . . 1.01 108.674 177.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.424 ' HD3' ' HB1' ' A' ' 50' ' ' ALA . 29.8 ttpt -50.81 -48.6 59.67 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.9 0.75 . . . . 1.47 109.864 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.665 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 44.2 ttp -49.35 -54.82 15.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.387 -0.824 . . . . 1.02 111.321 177.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.688 ' O ' HG13 ' A' ' 107' ' ' ILE . 30.0 m -61.92 -51.96 66.0 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.322 -0.399 . . . . 1.04 110.592 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 29.2 mt -46.48 -54.7 8.74 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.835 -0.62 . . . . 1.04 110.17 174.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.478 ' CG ' HD13 ' A' ' 48' ' ' LEU . 90.8 mt-30 -52.17 -43.87 64.34 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.747 -1.115 . . . . 1.96 112.262 176.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.665 ' HG3' ' O ' ' A' ' 102' ' ' MET . 38.0 mt-30 -64.3 -40.65 96.37 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.952 0.882 . . . . 3.11 108.966 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.688 HG13 ' O ' ' A' ' 103' ' ' THR . 7.8 mt -68.88 -42.22 82.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 114.29 -1.323 . . . . 1.03 111.163 -178.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 104' ' ' LEU . 7.2 mt -66.91 -37.64 79.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.413 -0.358 . . . . 1.04 111.471 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.4 t -59.58 -28.85 67.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.699 0.285 . . . . 1.67 110.587 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -59.41 -53.6 56.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.281 -0.637 . . . . 1.99 109.281 173.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.554 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 11.5 m-85 -86.99 32.97 0.66 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.2 -0.909 . . . . 1.0 110.265 176.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? -122.19 -44.62 2.27 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.384 -1.339 . . . . 1.46 107.384 174.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -70.4 -37.34 74.48 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.743 -1.117 . . . . 2.27 109.392 168.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -106.41 61.01 0.64 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.361 -0.836 . . . . 1.47 109.761 175.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.554 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 35.2 t70 . . . . . 0 C--O 1.249 1.038 0 CA-C-N 115.268 -0.878 . . . . 2.72 110.313 -178.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 N-CA-C 111.685 -0.566 . . . . 20.26 111.685 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 520' ' ' SER . . . . . 0.456 ' HB3' ' HB2' ' B' ' 523' ' ' TYR . 49.0 m -131.25 80.73 67.63 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-O 120.721 0.296 . . . . 18.54 110.458 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.8 85.14 1.36 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.789 2.326 . . . . 17.79 112.704 -178.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 88.75 40.38 6.31 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.774 -0.727 . . . . 16.44 112.653 177.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . 0.456 ' HB2' ' HB3' ' B' ' 520' ' ' SER . 97.4 m-85 -126.67 79.92 70.98 Favored Pre-proline 0 C--N 1.326 -0.423 0 N-CA-C 110.27 -0.271 . . . . 16.12 110.27 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -86.86 15.25 2.23 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.555 2.17 . . . . 13.81 113.032 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 53.42 40.67 31.69 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.641 -0.709 . . . . 12.88 110.326 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -87.34 -81.03 1.21 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.845 -0.693 . . . . 9.73 112.973 -175.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.95 24.6 2.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.984 0.421 . . . . 8.74 111.168 -177.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 64.4 mt -73.07 8.74 1.45 Allowed 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 112.993 0.738 . . . . 10.79 112.993 -172.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 6.8 m -143.32 -47.91 0.3 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.033 0.444 . . . . 7.62 111.581 -178.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 113.22 -2.94 25.32 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 110.445 -1.062 . . . . 5.26 110.445 -171.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -142.25 40.39 1.61 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.26 -0.97 . . . . 5.5 108.751 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -95.9 -2.47 47.2 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.482 -0.781 . . . . 5.68 112.438 -171.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -96.76 -62.63 1.23 Allowed 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.761 -0.654 . . . . 3.22 112.66 -171.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -114.76 -40.57 3.53 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.191 0.52 . . . . 5.14 111.073 -175.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 535' ' ' SER . . . . . 0.478 ' HB2' HH22 ' A' ' 61' ' ' ARG . 2.9 p -75.47 -3.11 32.09 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.479 -0.782 . . . . 1.34 110.415 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 56.1 p -77.44 -56.29 4.67 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.328 -0.851 . . . . 2.43 109.69 172.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 44.9 mm -70.3 -38.71 75.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.356 -0.838 . . . . 1.69 110.267 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -76.29 3.03 11.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.886 -0.597 . . . . 1.36 111.168 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.477 ' HB2' ' O ' ' B' ' 535' ' ' SER . 27.4 t70 -89.42 -43.51 10.82 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.901 -0.777 . . . . 1.23 108.901 172.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 52.7 mtm -65.38 -30.54 71.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.301 -0.863 . . . . 2.83 109.467 172.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -53.51 -40.65 65.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.827 -1.079 . . . . 1.18 110.529 171.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.436 ' HZ ' ' C ' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -82.97 -42.5 17.51 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.747 -1.115 . . . . 0.66 111.272 -173.411 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 14.8 t -56.84 -36.32 69.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.658 -0.701 . . . . 2.08 111.143 -175.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -71.78 -28.21 63.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.316 -0.402 . . . . 1.34 111.502 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 87.0 mt -70.38 -39.89 74.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.246 -0.433 . . . . 1.82 111.924 -176.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . 0.435 HD12 HE21 ' A' ' 49' ' ' GLN . 5.1 mt -84.71 -7.62 59.15 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.33 0.586 . . . . 1.54 109.91 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 29.7 t -110.05 21.94 16.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.032 -0.985 . . . . 1.92 110.487 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 76.6 mm-40 -68.17 -54.4 18.18 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.6 0.714 . . . . 3.31 110.689 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 31.6 mt -85.24 74.17 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.148 0 CA-C-N 114.801 -1.091 . . . . 5.68 109.591 177.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 5.7 p -80.95 72.8 7.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.781 -0.645 . . . . 6.4 110.888 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 51.0 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.462 -0.78 . . . . 7.59 110.218 178.681 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo . . . . . 0 N--CA 1.479 0.663 0 N-CA-C 110.66 -0.554 . . . . 2.47 110.66 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.5 p -65.19 -27.9 69.02 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.034 0.383 . . . . 2.05 112.034 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.515 ' CD2' HG23 ' A' ' 103' ' ' THR . 74.5 m80 70.11 -9.23 0.75 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.502 0.721 . . . . 1.08 112.015 -178.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.1 p -154.27 163.19 40.52 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 119.817 -0.753 . . . . 1.78 112.293 -176.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.434 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 177.0 -158.0 23.41 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 110.424 -1.07 . . . . 0.16 110.424 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.54 135.07 44.83 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 117.386 0.593 . . . . 1.04 110.472 179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.512 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -147.26 142.74 27.53 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.274 -0.421 . . . . 1.02 111.247 -177.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.754 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 62.3 mt -101.72 126.46 55.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.993 -0.373 . . . . 1.17 109.993 175.041 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.447 ' O ' HG13 ' A' ' 12' ' ' VAL . 21.2 t80 -129.51 129.92 45.14 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.581 -0.896 . . . . 0.43 108.581 177.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 62.45 29.12 17.1 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 123.386 0.429 . . . . 0.8 110.5 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm 68.52 -0.12 2.38 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.982 0.734 . . . . 2.57 112.982 178.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.447 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.7 OUTLIER -92.86 116.86 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 108.228 -1.027 . . . . 1.1 108.228 166.915 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.5 p -73.24 142.27 47.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.29 -0.414 . . . . 1.5 110.42 -176.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.476 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -158.42 -158.17 8.87 Favored Glycine 0 N--CA 1.438 -1.21 0 C-N-CA 119.835 -1.174 . . . . 0.12 113.732 -176.078 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.8 mm -125.98 132.02 71.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.972 -0.614 . . . . 1.02 109.451 -177.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.429 HD12 HD13 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.25 136.38 34.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 110.014 -0.365 . . . . 1.05 110.014 -177.181 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.09 129.84 30.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.9 0.381 . . . . 1.04 111.318 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.505 HD12 ' HA ' ' A' ' 3' ' ' HIS . 65.4 mt -86.25 132.64 31.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 110.011 -0.366 . . . . 1.04 110.011 177.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -105.29 101.88 11.4 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.128 -0.487 . . . . 1.98 110.608 -175.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -116.5 167.95 10.6 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.374 -0.602 . . . . 1.2 109.374 175.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 76.8 -2.56 2.66 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 122.165 0.984 . . . . 0.58 109.964 -175.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.602 HG21 ' O ' ' A' ' 23' ' ' SER . 30.4 m -102.64 -174.52 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.022 0 CA-C-N 114.051 -1.431 . . . . 1.05 109.324 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.602 ' O ' HG21 ' A' ' 22' ' ' VAL . 75.6 m -72.4 167.14 35.36 Favored Pre-proline 0 C--N 1.314 -0.942 0 N-CA-C 105.198 -2.149 . . . . 1.77 105.198 175.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.411 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 94.8 Cg_exo -41.9 127.75 3.78 Favored 'Trans proline' 0 C--N 1.354 0.85 0 CA-C-N 121.213 1.469 . . . . 0.19 112.136 -141.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.475 ' H ' ' HH ' ' A' ' 111' ' ' TYR . . . -52.07 139.32 23.32 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 113.97 -1.468 . . . . 1.03 112.17 -163.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 24' ' ' PRO . 0.7 OUTLIER -125.48 168.44 13.63 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 114.225 -1.352 . . . . 0.32 111.823 -169.847 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.5 ' HB3' HG23 ' A' ' 40' ' ' VAL . 3.3 tm? -116.83 105.42 12.35 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 107.365 -1.346 . . . . 1.02 107.365 174.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.6 m -101.85 107.09 18.17 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 121.061 0.458 . . . . 1.02 111.122 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.9 t90 -85.21 132.04 34.34 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.044 -0.725 . . . . 0.17 109.044 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.557 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 66.2 mtp180 -123.06 163.22 20.92 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 109.039 -0.726 . . . . 2.24 109.039 172.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 p -71.26 177.52 3.83 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 108.95 -0.759 . . . . 0.63 108.95 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.476 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.0 OUTLIER -58.34 -36.68 73.81 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.316 -0.553 . . . . 0.96 111.017 179.684 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -88.98 -31.23 18.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.608 0.718 . . . . 2.12 109.91 171.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.557 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 96.76 16.25 36.96 Favored Glycine 0 N--CA 1.447 -0.613 0 CA-C-N 114.978 -1.01 . . . . 0.23 112.1 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -62.18 -43.47 98.75 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.084 -0.71 . . . . 1.73 109.084 172.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.1 tttt -89.9 141.73 28.37 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.76 -0.83 . . . . 1.91 108.76 174.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.511 HG21 ' HG2' ' A' ' 30' ' ' ARG . 7.9 p -149.4 136.46 13.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.942 0.401 . . . . 1.04 111.272 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -144.28 127.26 16.44 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.634 -0.506 . . . . 0.54 109.634 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 36.7 m -117.11 132.83 56.58 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.812 0.671 . . . . 1.04 112.812 -173.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.5 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -99.27 130.05 48.81 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.611 0 N-CA-C 108.017 -1.105 . . . . 1.04 108.017 168.693 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.403 ' O ' HG12 ' A' ' 45' ' ' ILE . 57.8 t -93.16 122.31 44.55 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 O-C-N 121.071 -1.018 . . . . 1.02 109.099 173.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.436 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -69.38 -19.38 63.83 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.736 0.643 . . . . 1.01 112.736 -170.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.7 p -69.8 -12.29 61.51 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.366 0.603 . . . . 1.07 109.635 174.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.7 p -112.62 13.8 20.02 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.328 -0.851 . . . . 1.03 109.879 179.76 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.521 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 25.5 mm -114.97 144.77 21.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.303 -0.629 . . . . 1.01 109.303 177.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -114.85 -37.39 4.2 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.691 0.281 . . . . 0.52 111.168 -177.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.432 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 9.8 mtmm -139.26 168.8 19.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.732 0.301 . . . . 1.95 111.43 -179.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.446 ' CD2' ' HB3' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -152.04 137.97 18.1 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 109.408 -0.59 . . . . 1.39 109.408 -179.521 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.407 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 8.4 mm100 -134.53 115.21 13.64 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 122.175 -0.328 . . . . 2.02 111.505 -171.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.536 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -114.44 144.41 43.35 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.765 -0.584 . . . . 1.05 112.195 -177.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.447 ' N ' ' HZ ' ' B' ' 542' ' ' PHE . 69.0 p -68.55 119.66 70.05 Favored Pre-proline 0 C--O 1.233 0.237 0 CA-C-N 115.418 -0.81 . . . . 1.05 110.784 -176.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.84 155.16 14.96 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.798 2.332 . . . . 0.44 111.723 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.6 -17.09 62.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 1.21 112.402 -174.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.5 t -99.81 -7.79 24.99 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.806 0.336 . . . . 1.94 110.766 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.2 m -71.87 138.5 48.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.218 0.532 . . . . 1.13 111.482 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -55.78 -23.66 31.16 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.038 -0.983 . . . . 1.77 111.084 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -88.67 148.55 23.96 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.874 -1.057 . . . . 2.18 111.875 -174.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.634 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -118.87 95.46 4.84 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.12 -1.067 . . . . 1.11 108.12 166.609 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.634 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -157.5 158.56 35.95 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.524 0.678 . . . . 1.05 112.505 -173.793 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.443 ' HG ' ' HB2' ' A' ' 50' ' ' ALA . 1.6 tt -140.67 119.89 12.94 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.651 -1.158 . . . . 1.05 108.318 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.689 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.2 mtp180 -102.53 147.53 26.65 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.426 0.631 . . . . 3.5 112.014 -178.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.54 HD22 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -125.32 105.3 9.0 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.431 -1.259 . . . . 1.03 108.987 178.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.532 ' N ' HD13 ' A' ' 63' ' ' ILE . 3.1 mp -88.91 106.15 16.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 110.137 -0.32 . . . . 1.11 110.137 -174.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.744 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -66.52 166.2 39.05 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.936 -0.575 . . . . 0.54 112.925 -178.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.521 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 83.0 mttt -84.33 124.34 31.16 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.861 0.363 . . . . 1.08 111.362 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.613 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 2.2 t -121.44 138.84 50.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 115.905 -0.589 . . . . 2.32 110.39 172.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.566 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 14.0 m-20 -83.21 80.42 9.07 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.433 -0.803 . . . . 3.23 108.995 177.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -69.25 -2.6 11.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.957 0.408 . . . . 2.39 111.42 -174.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.9 p -65.12 -17.33 64.38 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.524 -0.547 . . . . 3.2 109.524 169.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.566 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -79.42 132.53 36.41 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.187 0.994 . . . . 2.95 110.528 176.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.4 mmtm -101.4 116.85 33.73 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 114.646 -1.161 . . . . 3.72 109.246 167.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.608 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 41.0 ttm180 -99.33 157.57 16.31 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.463 -0.94 . . . . 4.12 108.463 176.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 50.9 mttp -128.25 147.19 50.58 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.811 -0.441 . . . . 4.59 109.811 174.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.29 -172.86 3.61 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.554 -0.748 . . . . 4.41 110.483 -175.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -58.55 -31.42 67.95 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.093 0.405 . . . . 5.69 112.093 -178.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.578 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 30.8 mt-10 -85.49 -22.69 28.1 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.907 -0.317 . . . . 5.38 110.96 -178.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 105.7 19.11 10.65 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.624 -0.798 . . . . 4.47 112.38 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.578 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 37.9 m-80 -77.88 140.61 39.34 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.383 -0.599 . . . . 4.72 109.383 177.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -74.23 95.67 2.66 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.469 -0.567 . . . . 4.28 109.469 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.608 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.3 m -107.88 98.79 7.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 109.003 -0.739 . . . . 3.51 109.003 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.411 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -89.0 114.55 60.62 Favored Pre-proline 0 C--N 1.316 -0.866 0 CA-C-N 115.892 -0.595 . . . . 2.87 110.375 -175.823 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 25.5 Cg_exo -67.0 135.97 39.5 Favored 'Trans proline' 0 CA--C 1.51 -0.721 0 C-N-CA 123.036 2.491 . . . . 2.06 113.716 -174.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.511 ' HG3' ' OH ' ' B' ' 523' ' ' TYR . 37.1 mtmm -95.43 162.46 24.47 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 114.18 -1.373 . . . . 3.13 109.309 172.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.744 ' HB3' ' O ' ' A' ' 64' ' ' GLY . 50.3 Cg_exo -50.54 152.47 8.95 Favored 'Trans proline' 0 C--O 1.233 0.234 0 C-N-CA 122.949 2.433 . . . . 0.99 113.617 179.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -91.58 124.44 35.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.181 -0.918 . . . . 2.11 109.615 -178.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.481 ' HG2' HG13 ' A' ' 63' ' ' ILE . 78.8 mtt180 -104.54 126.39 51.58 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 121.727 0.775 . . . . 3.17 111.079 -172.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.497 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 79.5 m-70 -95.25 146.3 24.44 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.505 -1.295 . . . . 0.72 107.505 177.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.689 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 19.5 ttm -140.74 130.55 24.39 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 118.914 0.779 . . . . 1.07 111.309 175.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.543 ' O ' ' HA ' ' A' ' 59' ' ' MET . 11.6 m-85 -116.61 138.05 51.72 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.371 -0.831 . . . . 0.27 109.614 178.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.754 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -81.06 159.04 24.87 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 109.078 -0.712 . . . . 1.68 109.078 174.381 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.402 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 18.1 m-85 -138.34 175.47 9.55 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.91 0.386 . . . . 0.32 111.478 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -130.63 -0.75 4.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.828 -0.624 . . . . 2.7 110.115 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.405 ' HB2' HG22 ' A' ' 96' ' ' VAL . 62.2 m-80 -147.1 133.55 19.69 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.176 -0.465 . . . . 1.16 110.223 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -72.01 -39.2 69.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.632 -0.713 . . . . 3.7 111.208 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.4 m -60.84 -33.44 73.05 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.994 -0.548 . . . . 1.13 110.696 -177.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.623 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.3 t -67.25 -61.44 1.69 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 CA-C-N 116.052 -0.522 . . . . 1.06 110.247 176.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.434 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.3 ptp -54.69 -38.58 67.18 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.25 -0.432 . . . . 1.02 111.234 -175.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.416 ' O ' ' HB2' ' A' ' 102' ' ' MET . 29.9 t70 -62.98 -47.72 81.93 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.333 -0.394 . . . . 0.34 110.511 177.369 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -68.95 -39.01 79.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.992 -0.549 . . . . 1.58 111.619 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.623 HG12 ' O ' ' A' ' 96' ' ' VAL . 35.7 mm -63.36 -58.92 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 109.039 -0.726 . . . . 1.01 109.039 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.536 ' HD3' ' HB2' ' A' ' 50' ' ' ALA . 14.6 ttpp -51.25 -47.76 62.34 Favored 'General case' 0 CA--C 1.508 -0.64 0 O-C-N 123.795 0.684 . . . . 1.47 109.818 177.661 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.674 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 37.8 ttp -51.19 -55.28 18.77 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.065 -0.971 . . . . 1.02 110.943 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.726 ' O ' HG13 ' A' ' 107' ' ' ILE . 31.9 m -60.41 -51.74 68.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.284 -0.416 . . . . 1.04 110.455 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 31.7 mt -47.38 -54.96 9.85 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.409 0.684 . . . . 1.04 110.312 175.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -53.7 -39.1 64.9 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.502 -1.226 . . . . 1.96 112.565 178.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.674 ' HG3' ' O ' ' A' ' 102' ' ' MET . 64.5 mt-30 -67.2 -42.46 84.09 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.863 0.839 . . . . 3.11 109.04 177.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.726 HG13 ' O ' ' A' ' 103' ' ' THR . 14.1 mt -64.8 -46.79 90.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.298 -1.319 . . . . 1.03 110.997 -179.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.554 HG13 ' O ' ' A' ' 104' ' ' LEU . 7.6 mt -61.95 -32.22 53.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.841 -0.618 . . . . 1.04 111.222 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 38.5 t -61.44 -31.51 71.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.488 -0.324 . . . . 1.67 110.399 178.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -63.57 -40.19 96.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.375 0.607 . . . . 1.99 109.387 175.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.475 ' HH ' ' H ' ' A' ' 25' ' ' ALA . 35.0 m-85 -97.7 18.28 15.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.445 -0.798 . . . . 1.0 110.103 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.09 -41.22 6.16 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 107.717 -1.216 . . . . 1.46 107.717 175.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.39 -36.53 74.14 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.773 -1.103 . . . . 2.27 109.457 169.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -105.89 54.73 0.69 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.315 -0.857 . . . . 1.47 109.894 174.429 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.507 ' OD2' ' HE2' ' A' ' 65' ' ' LYS . 11.1 t70 . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.662 -0.685 . . . . 2.72 110.028 -178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.671 0 N-CA-C 111.833 -0.507 . . . . 20.26 111.833 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 5.4 p -90.46 144.79 31.29 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 110.487 -0.19 . . . . 18.54 110.487 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -76.27 41.71 0.9 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.02 2.48 . . . . 17.79 112.233 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 84.61 5.31 86.84 Favored Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.782 -0.644 . . . . 16.44 112.491 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . 0.511 ' OH ' ' HG3' ' A' ' 83' ' ' LYS . 76.8 m-85 -140.96 134.78 14.92 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 120.822 0.344 . . . . 16.12 111.203 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 92.8 Cg_endo -78.14 170.0 19.41 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.061 2.508 . . . . 13.81 111.992 176.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 58.9 t30 63.8 79.56 0.25 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.447 0.641 . . . . 12.88 110.18 -177.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -63.07 -33.96 88.67 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.455 -0.793 . . . . 9.73 113.562 -173.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . 0.553 HD13 ' H ' ' B' ' 527' ' ' LEU . 0.0 OUTLIER -79.49 8.95 5.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.274 0.537 . . . . 8.74 112.423 -176.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 40.8 tp -75.71 -5.52 46.06 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 107.777 -1.194 . . . . 10.79 107.777 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 65.0 m -161.02 60.33 0.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 113.766 -1.561 . . . . 7.62 107.727 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -48.21 -40.03 21.22 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 114.935 -1.03 . . . . 5.26 114.511 -169.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -123.33 11.62 9.37 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.067 0.461 . . . . 5.5 110.096 178.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -110.19 -2.2 16.99 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.738 -0.665 . . . . 5.68 111.882 -176.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.7 -33.64 31.07 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.005 -0.543 . . . . 3.22 109.983 178.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -65.86 -39.74 91.02 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.633 0.73 . . . . 5.14 110.131 176.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 3.7 p -73.17 -20.36 60.91 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.004 -0.998 . . . . 1.34 110.513 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 71.2 m -74.17 -35.23 63.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.345 -0.388 . . . . 2.43 110.328 174.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . 0.408 HD12 ' HA ' ' B' ' 537' ' ' ILE . 9.8 mm -76.77 -31.42 19.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.015 0.436 . . . . 1.69 110.381 174.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -75.98 3.28 10.59 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.389 0.614 . . . . 1.36 110.427 175.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.572 ' HB2' ' NH1' ' A' ' 61' ' ' ARG . 26.3 t70 -84.16 -31.88 24.92 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.295 -0.866 . . . . 1.23 109.461 174.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -60.92 -26.91 67.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.334 -0.848 . . . . 2.83 110.431 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -61.81 -37.68 85.32 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.955 -0.566 . . . . 1.18 110.005 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.447 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -69.5 -35.04 75.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.46 -0.791 . . . . 0.66 111.583 -175.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 23.0 t -58.16 -33.25 69.01 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.971 -0.559 . . . . 2.08 110.556 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -78.36 -32.76 49.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.108 -0.496 . . . . 1.34 110.857 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . 0.561 ' O ' ' HG3' ' B' ' 548' ' ' GLN . 88.2 mt -76.39 -37.98 56.35 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.599 0.592 . . . . 1.82 112.599 -175.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 20.3 mt -81.52 -11.2 59.27 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.53 0.681 . . . . 1.54 109.978 -177.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 43.3 m -92.6 -56.12 3.13 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.955 -1.021 . . . . 1.92 110.238 173.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' B' ' 545' ' ' LEU . 86.2 mt-30 51.89 54.33 11.08 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.227 0.537 . . . . 3.31 110.992 -179.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 49.5 mm -115.5 -44.47 3.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.394 -0.821 . . . . 5.68 109.773 178.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 32.5 t -113.69 24.11 12.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.634 -0.712 . . . . 6.4 109.921 179.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 50.5 m . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.369 -0.824 . . . . 7.59 109.784 178.866 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo . . . . . 0 N--CA 1.477 0.517 0 N-CA-C 110.567 -0.59 . . . . 2.47 110.567 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.4 m -47.65 -60.17 2.75 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.914 1.079 . . . . 2.05 113.914 -171.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.409 ' HA ' HD12 ' A' ' 18' ' ' ILE . 73.1 m80 65.53 -11.29 0.18 Allowed 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.159 0.583 . . . . 1.08 112.365 -173.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.2 p -156.91 166.2 34.02 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.519 0.563 . . . . 1.78 112.519 -171.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.472 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 174.45 -166.67 38.68 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.595 -1.002 . . . . 0.16 110.595 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.3 134.33 36.9 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 117.798 0.799 . . . . 1.04 110.301 178.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -147.36 144.74 28.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.171 0.51 . . . . 1.02 111.628 -178.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.448 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 98.2 mt -102.79 119.42 51.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.848 -0.615 . . . . 1.17 110.166 176.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.427 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.8 t80 -126.1 137.2 53.59 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 109.142 -0.688 . . . . 0.43 109.142 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 62.07 22.95 13.48 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.522 0.514 . . . . 0.8 109.761 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt 67.92 5.22 4.4 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.279 -0.873 . . . . 2.57 112.764 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.427 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.5 OUTLIER -95.48 126.88 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 108.671 -0.863 . . . . 1.1 108.671 166.447 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.423 ' HA ' HG12 ' A' ' 8' ' ' ILE . 27.3 p -77.35 142.8 39.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.226 0.536 . . . . 1.5 111.049 -175.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.92 -158.59 9.8 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 120.26 -0.971 . . . . 0.12 113.228 -177.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 35.1 mm -125.29 131.41 72.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 109.351 -0.611 . . . . 1.02 109.351 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.424 HD12 HD13 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -101.99 135.07 40.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 120.788 0.327 . . . . 1.05 110.144 -176.726 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.65 130.95 32.98 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.22 -0.446 . . . . 1.04 111.024 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' A' ' 3' ' ' HIS . 34.3 mt -85.03 137.44 20.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.271 0.557 . . . . 1.04 110.171 177.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -109.31 105.05 14.3 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.144 -0.935 . . . . 1.98 111.232 -173.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.473 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -124.05 169.96 11.14 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.168 -0.469 . . . . 1.2 109.744 176.04 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.473 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.6 t70 80.96 -6.12 1.64 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 122.452 1.12 . . . . 0.58 109.293 -173.077 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.593 HG21 ' O ' ' A' ' 23' ' ' SER . 32.4 m -102.33 -172.48 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-N 113.699 -1.591 . . . . 1.05 109.128 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.593 ' O ' HG21 ' A' ' 22' ' ' VAL . 19.9 m -72.07 167.48 31.42 Favored Pre-proline 0 C--N 1.316 -0.878 0 N-CA-C 105.687 -1.968 . . . . 1.77 105.687 175.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -41.7 127.39 3.47 Favored 'Trans proline' 0 C--N 1.352 0.719 0 CA-C-N 120.81 1.325 . . . . 0.19 112.728 -143.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.453 ' HB1' ' CG2' ' A' ' 107' ' ' ILE . . . -45.22 138.15 4.13 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 113.61 -1.632 . . . . 1.03 112.739 -166.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.55 169.34 12.0 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 113.908 -1.496 . . . . 0.32 111.615 -169.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.493 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.1 tm? -117.81 108.92 15.94 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 107.761 -1.2 . . . . 1.02 107.761 173.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.3 m -104.26 108.26 19.57 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.015 0.436 . . . . 1.02 111.176 -176.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.2 t90 -86.43 130.45 34.5 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.211 -0.662 . . . . 0.17 109.211 172.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.441 ' HG2' HG23 ' A' ' 37' ' ' VAL . 78.1 mtt180 -123.36 157.3 33.62 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 109.027 -0.731 . . . . 2.24 109.027 172.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.2 p -70.38 177.95 3.14 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.486 -0.561 . . . . 0.63 109.486 178.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.2 p -62.45 -38.29 89.21 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.905 -0.718 . . . . 0.96 110.405 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -78.8 -33.01 46.56 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.811 0.815 . . . . 2.12 108.969 171.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.403 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 91.89 10.53 61.3 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 114.459 -1.246 . . . . 0.23 112.637 177.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -65.44 -48.79 71.52 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.586 -0.524 . . . . 1.73 109.586 175.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.4 tttm -77.25 134.31 38.61 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.821 -0.807 . . . . 1.91 108.821 172.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.441 HG23 ' HG2' ' A' ' 30' ' ' ARG . 13.6 p -149.39 136.49 13.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 120.672 0.273 . . . . 1.04 110.701 -177.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -144.49 132.85 21.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.667 0.27 . . . . 0.54 110.316 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.426 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 37.0 m -116.52 133.43 56.02 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.501 0.556 . . . . 1.04 112.501 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.493 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.44 129.8 53.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.599 0 N-CA-C 108.383 -0.969 . . . . 1.04 108.383 169.247 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.6 t -92.53 119.63 40.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 O-C-N 121.207 -0.933 . . . . 1.02 108.805 173.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.445 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.6 mm? -66.94 -18.18 65.26 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.984 0.735 . . . . 1.01 112.984 -170.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.417 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 44.3 t -70.81 -14.94 62.6 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.204 -0.598 . . . . 1.07 109.624 175.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.433 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 3.5 p -109.34 9.97 25.61 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.517 -0.765 . . . . 1.03 110.002 -178.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.457 HG22 ' CD1' ' A' ' 62' ' ' LEU . 31.0 mm -110.36 137.91 40.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.831 -0.622 . . . . 1.01 109.327 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -103.29 -40.22 6.49 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.319 -0.4 . . . . 0.52 110.591 -175.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.585 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 25.2 mtpp -139.79 174.51 10.44 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.406 0.622 . . . . 1.95 111.962 -178.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.517 HD13 ' CG ' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -152.92 137.57 16.9 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.785 -1.098 . . . . 1.39 108.754 176.898 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -134.02 118.41 17.78 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 122.436 -0.165 . . . . 2.02 111.416 -173.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.413 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -117.42 144.09 45.34 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 122.062 -0.399 . . . . 1.05 111.693 -177.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.524 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 74.2 p -70.67 121.28 83.25 Favored Pre-proline 0 N--CA 1.463 0.202 0 CA-C-N 115.884 -0.598 . . . . 1.05 111.162 -175.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.576 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 22.6 Cg_exo -58.41 160.55 16.45 Favored 'Trans proline' 0 CA--C 1.528 0.204 0 C-N-CA 122.866 2.378 . . . . 0.44 111.939 175.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.16 -13.92 62.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 1.21 111.364 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.3 p -91.87 -15.49 28.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.263 0.554 . . . . 1.94 110.547 176.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.576 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 20.9 m -71.85 143.26 49.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.618 -0.719 . . . . 1.13 111.608 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -69.16 -8.32 44.44 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 114.951 -1.022 . . . . 1.77 110.653 176.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.442 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 30.5 mmtm -105.39 155.74 18.84 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 114.79 -1.095 . . . . 2.18 111.121 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.524 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 72.5 mmm -133.0 98.27 4.24 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.174 -0.676 . . . . 1.11 109.174 169.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.558 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.2 OUTLIER -157.88 160.59 37.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.01 -0.541 . . . . 1.05 111.562 -171.037 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.425 HD11 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -136.99 118.77 15.09 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.387 -0.968 . . . . 1.05 108.387 176.748 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.486 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 2.2 mtp180 -103.64 136.87 42.55 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.211 0.529 . . . . 3.5 111.439 -178.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.572 ' HB2' ' HB2' ' A' ' 87' ' ' HIS . 1.4 mm? -109.03 107.6 18.0 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.055 -0.975 . . . . 1.03 109.243 174.039 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.585 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.3 mp -85.56 101.7 10.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 110.137 -0.32 . . . . 1.11 110.137 -174.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.475 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -65.25 153.62 50.64 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 116.111 -0.495 . . . . 0.54 112.273 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.433 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 86.8 mttt -70.4 150.28 46.42 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.129 0.49 . . . . 1.08 111.758 -176.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.464 ' CG2' ' HG3' ' A' ' 84' ' ' PRO . 0.8 OUTLIER -107.27 110.75 32.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 CA-C-N 115.677 -0.692 . . . . 2.32 111.67 -173.369 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.831 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 15.2 t70 -88.0 86.37 7.11 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 107.965 -1.124 . . . . 3.23 107.965 168.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -75.76 -9.09 58.3 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.773 0.321 . . . . 2.39 110.963 -174.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.1 p -66.87 -9.52 38.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.061 0.458 . . . . 3.2 110.618 174.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.831 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 4.9 ptpp? -86.43 33.3 0.63 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.011 -0.541 . . . . 2.95 110.386 173.886 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -43.72 113.33 0.5 Allowed 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.474 0.654 . . . . 3.72 109.746 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 73.5 ttt180 -102.07 165.67 11.03 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 114.872 -1.058 . . . . 4.12 109.064 -167.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 85.8 mttt -134.67 150.43 50.63 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.607 -0.516 . . . . 4.59 109.607 171.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.5 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.8 OUTLIER -84.69 -170.85 3.32 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.606 -0.725 . . . . 4.41 110.416 -177.619 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -59.15 -32.13 69.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.772 0.32 . . . . 5.69 111.619 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.5 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 19.4 mt-10 -80.68 -45.13 17.67 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.931 0.396 . . . . 5.38 110.528 -179.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 130.77 17.08 1.55 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.69 -0.767 . . . . 4.47 112.466 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.547 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 36.6 m-80 -76.03 133.7 40.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.703 -0.48 . . . . 4.72 109.703 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.414 ' HA ' ' HG2' ' A' ' 73' ' ' LYS . 43.7 tt0 -71.16 93.76 1.09 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.255 0.55 . . . . 4.28 110.499 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.492 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 28.3 m -98.75 100.17 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-O 121.727 0.775 . . . . 3.51 109.455 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -86.88 107.48 14.37 Favored Pre-proline 0 C--N 1.316 -0.873 0 N-CA-C 108.715 -0.846 . . . . 2.87 108.715 176.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -58.1 139.05 89.04 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 123.535 2.824 . . . . 2.06 113.579 -170.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.503 ' HB2' ' HD2' ' A' ' 84' ' ' PRO . 17.9 ptpt -80.46 168.91 22.1 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 114.73 -1.123 . . . . 3.13 109.688 176.601 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.503 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 21.0 Cg_exo -57.05 150.29 57.27 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.006 1.804 . . . . 0.99 112.251 -178.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -88.4 111.87 22.26 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.351 -0.981 . . . . 2.11 108.351 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.417 ' HG2' HG13 ' A' ' 63' ' ' ILE . 95.8 mtt180 -104.47 115.24 30.02 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.887 -0.597 . . . . 3.17 110.196 -173.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.572 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 57.8 m-70 -93.9 110.24 21.92 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.774 -0.824 . . . . 0.72 108.774 -174.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.558 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 23.5 ttm -102.71 125.03 49.3 Favored 'General case' 0 CA--C 1.502 -0.87 0 C-N-CA 120.05 -0.66 . . . . 1.07 111.012 -175.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -112.83 125.33 54.23 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.271 -0.877 . . . . 0.27 109.199 174.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.462 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.07 148.41 29.67 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.828 -0.434 . . . . 1.68 109.828 178.063 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.42 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 19.8 m-85 -130.01 168.57 16.5 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.283 0.563 . . . . 0.32 111.783 -172.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -120.51 -11.11 9.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.143 -0.935 . . . . 2.7 109.833 175.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -136.85 128.67 29.06 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.373 0.606 . . . . 1.16 110.814 -178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.448 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.2 mmm180 -68.03 -35.91 79.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.117 -0.947 . . . . 3.7 111.881 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.0 m -61.63 -37.97 85.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.783 0.325 . . . . 1.13 110.747 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.586 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.5 t -66.17 -58.41 6.78 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 CA-C-N 116.221 -0.445 . . . . 1.06 110.468 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.456 ' HG3' ' N ' ' A' ' 98' ' ' ASP . 13.0 ptp -55.8 -39.49 71.37 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.333 -0.394 . . . . 1.02 111.286 -176.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.456 ' N ' ' HG3' ' A' ' 97' ' ' MET . 28.7 t70 -65.65 -39.25 91.19 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.87 -0.332 . . . . 0.34 110.332 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -74.44 -40.13 62.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.175 -0.466 . . . . 1.58 111.433 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.586 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.6 mm -61.72 -57.23 13.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 108.692 -0.855 . . . . 1.01 108.692 176.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.413 ' HD3' ' HB2' ' A' ' 50' ' ' ALA . 30.0 ttpt -50.66 -49.69 56.43 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 124.09 0.868 . . . . 1.47 109.848 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.466 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.0 ttp -49.98 -52.65 32.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.562 -0.745 . . . . 1.02 111.26 178.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.669 ' O ' HG13 ' A' ' 107' ' ' ILE . 23.3 m -59.68 -56.82 17.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.992 -0.549 . . . . 1.04 110.169 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 26.4 mt -45.6 -54.79 7.13 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.207 -0.906 . . . . 1.04 110.663 176.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.517 ' CG ' HD13 ' A' ' 48' ' ' LEU . 92.9 mt-30 -51.56 -46.33 63.36 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.704 -1.135 . . . . 1.96 112.488 177.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 102' ' ' MET . 17.5 mm100 -67.14 -34.77 78.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.46 0.648 . . . . 3.11 109.968 -179.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.669 HG13 ' O ' ' A' ' 103' ' ' THR . 7.3 mt -71.35 -46.25 65.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 114.669 -1.15 . . . . 1.03 110.924 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 104' ' ' LEU . 6.3 mt -59.24 -42.13 86.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.255 -0.43 . . . . 1.04 111.287 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.0 t -57.09 -28.33 62.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.5 -0.318 . . . . 1.67 111.12 -177.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -60.95 -39.0 87.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.408 0.623 . . . . 1.99 109.938 176.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.417 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 21.0 m-85 -94.47 -16.23 23.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.265 -0.88 . . . . 1.0 110.205 -178.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.448 ' HA ' ' OD2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -71.5 -28.51 63.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.527 -0.761 . . . . 1.46 109.039 176.841 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.43 -2.28 45.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.259 -0.882 . . . . 2.27 110.23 172.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -109.48 9.65 25.37 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.329 -0.85 . . . . 1.47 110.248 175.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.448 ' OD2' ' HA ' ' A' ' 112' ' ' LYS . 39.9 m-20 . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.621 -0.704 . . . . 2.72 110.184 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 111.77 -0.532 . . . . 20.26 111.77 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 520' ' ' SER . . . . . 0.41 ' HA ' ' HD3' ' B' ' 521' ' ' PRO . 35.3 t -160.56 131.43 3.75 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 110.179 -0.304 . . . . 18.54 110.179 -179.025 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' B' ' 520' ' ' SER . 36.7 Cg_exo -64.63 -7.52 14.81 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 123.107 2.538 . . . . 17.79 112.307 176.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 94.38 -121.24 6.65 Favored Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 121.008 -0.615 . . . . 16.44 111.831 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -138.34 139.17 24.33 Favored Pre-proline 0 C--N 1.32 -0.687 0 N-CA-C 110.358 -0.238 . . . . 16.12 110.358 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -54.55 119.34 6.26 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.09 2.527 . . . . 13.81 112.335 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -87.75 -24.63 23.75 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.097 -0.501 . . . . 12.88 110.596 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -99.95 29.8 11.39 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.621 -0.799 . . . . 9.73 112.731 -175.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' B' ' 529' ' ' SER . 1.3 pp -80.95 6.37 13.54 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.36 0.6 . . . . 8.74 111.57 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 30.4 tp -81.14 5.65 16.16 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.346 -0.983 . . . . 10.79 108.346 172.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 529' ' ' SER . . . . . 0.405 ' H ' ' C ' ' B' ' 527' ' ' LEU . 30.4 t -151.62 -47.62 0.11 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.304 -1.316 . . . . 7.62 109.248 -177.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 95.41 -41.43 2.48 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.865 -0.683 . . . . 5.26 112.616 176.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -91.64 -14.99 29.2 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 122.306 1.05 . . . . 5.5 108.99 -174.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -101.9 2.49 38.1 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 113.962 -1.472 . . . . 5.68 110.95 -175.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -85.72 -32.32 21.97 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.725 -1.125 . . . . 3.22 109.996 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -70.21 -34.03 72.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.647 -0.706 . . . . 5.14 110.526 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 1.4 p -77.42 -17.03 58.49 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.56 -0.746 . . . . 1.34 110.861 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 536' ' ' SER . . . . . 0.47 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 64.5 m -78.14 -34.02 50.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.149 0.499 . . . . 2.43 110.115 175.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 28.5 mm -82.75 -32.28 9.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.095 -0.502 . . . . 1.69 110.024 174.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -75.88 1.08 16.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.796 0.808 . . . . 1.36 110.318 174.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.47 ' HB3' ' O ' ' B' ' 536' ' ' SER . 25.2 t70 -81.33 -40.85 22.95 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.848 -1.069 . . . . 1.23 108.548 171.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 91.5 mtp -64.08 -31.62 72.88 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.678 -1.146 . . . . 2.83 109.798 174.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -55.14 -43.71 74.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.146 -0.934 . . . . 1.18 110.198 175.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.41 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -66.8 -36.72 83.03 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.594 -0.73 . . . . 0.66 111.251 -177.054 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 32.9 t -59.92 -34.57 73.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.918 -0.583 . . . . 2.08 110.369 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . 0.45 ' O ' ' HG2' ' B' ' 548' ' ' GLN . . . -80.56 -17.95 49.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.94 -0.573 . . . . 1.34 111.472 -179.381 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 72.6 mt -88.14 -45.93 9.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.989 0.423 . . . . 1.82 112.096 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 17.5 mt -74.51 -14.72 60.85 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.32 0.581 . . . . 1.54 110.702 -175.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 25.3 p -79.6 -19.66 48.78 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.584 -0.735 . . . . 1.92 110.419 174.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' B' ' 544' ' ' ALA . 14.8 mm100 -69.6 -40.22 76.78 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.545 0.688 . . . . 3.31 110.732 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 32.1 pt -94.21 28.8 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.678 -1.146 . . . . 5.68 111.368 -177.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 35.0 t -92.47 -1.01 57.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.889 0.376 . . . . 6.4 110.218 178.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 32.5 t . . . . . 0 C--O 1.246 0.917 0 CA-C-O 118.462 -0.78 . . . . 7.59 109.341 177.364 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo . . . . . 0 N--CA 1.48 0.735 0 N-CA-C 110.569 -0.589 . . . . 2.47 110.569 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.0 p -76.13 -21.46 56.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.753 0.311 . . . . 2.05 111.244 -177.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.55 ' HA ' HD11 ' A' ' 18' ' ' ILE . 77.2 m80 64.65 -0.32 0.98 Allowed 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.807 -0.633 . . . . 1.08 112.304 178.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.8 p -157.78 161.77 38.45 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 119.72 -0.792 . . . . 1.78 112.376 -175.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.477 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.02 -165.72 34.84 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 115.009 -0.996 . . . . 0.16 110.749 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.19 130.55 45.51 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.23 0.515 . . . . 1.04 110.44 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.63 143.58 30.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.043 0.449 . . . . 1.02 111.351 -177.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.403 HG12 ' HA ' ' A' ' 13' ' ' SER . 74.2 mt -99.23 128.27 51.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.647 -0.501 . . . . 1.17 109.647 174.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.51 ' O ' HG13 ' A' ' 12' ' ' VAL . 15.0 t80 -139.31 138.55 36.79 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.992 -0.744 . . . . 0.43 108.992 178.022 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 64.35 24.88 13.34 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.65 0.594 . . . . 0.8 109.494 -176.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp 65.72 1.02 1.64 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 114.992 -1.004 . . . . 2.57 113.027 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.51 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -94.53 130.06 43.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.863 -0.791 . . . . 1.1 108.863 168.688 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.403 ' HA ' HG12 ' A' ' 8' ' ' ILE . 20.4 m -78.68 144.08 35.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.824 0.345 . . . . 1.5 110.609 -175.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.34 -158.97 9.92 Favored Glycine 0 N--CA 1.439 -1.148 0 C-N-CA 119.92 -1.133 . . . . 0.12 113.743 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.4 mm -127.59 134.53 65.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.862 -0.792 . . . . 1.02 108.862 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -104.97 136.91 36.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.603 -0.271 . . . . 1.05 110.337 -176.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.68 130.03 31.52 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.911 0.386 . . . . 1.04 111.436 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.55 HD11 ' HA ' ' A' ' 3' ' ' HIS . 64.3 mt -86.2 135.45 25.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.308 -0.405 . . . . 1.04 110.022 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -106.75 103.36 12.78 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.005 -0.543 . . . . 1.98 110.902 -175.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.41 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 21.1 mt-10 -119.2 169.47 9.93 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.81 -0.811 . . . . 1.2 108.81 175.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 36.3 t70 78.97 -2.25 2.28 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.445 1.117 . . . . 0.58 109.443 -176.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.623 HG22 ' O ' ' A' ' 23' ' ' SER . 34.8 m -104.0 -173.01 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-N 113.675 -1.602 . . . . 1.05 110.314 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.623 ' O ' HG22 ' A' ' 22' ' ' VAL . 75.6 m -72.06 167.63 30.02 Favored Pre-proline 0 C--N 1.316 -0.889 0 N-CA-C 105.23 -2.137 . . . . 1.77 105.23 172.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -41.77 129.06 3.93 Favored 'Trans proline' 0 C--N 1.355 0.917 0 CA-C-N 121.345 1.516 . . . . 0.19 112.577 -144.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.438 ' HB1' ' CG2' ' A' ' 107' ' ' ILE . . . -52.77 142.64 18.31 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 114.124 -1.398 . . . . 1.03 112.336 -163.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.26 169.11 13.86 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 114.332 -1.304 . . . . 0.32 111.787 -169.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.5 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.2 tm? -120.75 105.5 10.8 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.803 -1.184 . . . . 1.02 107.803 174.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.9 m -102.48 107.5 18.49 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 121.072 0.463 . . . . 1.02 111.414 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.8 t90 -85.17 132.32 34.31 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.222 -0.659 . . . . 0.17 109.222 172.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HG2' HG22 ' A' ' 37' ' ' VAL . 63.7 mtt180 -125.75 159.37 32.53 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 108.92 -0.77 . . . . 2.24 108.92 173.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 p -69.25 176.44 3.3 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 109.31 -0.626 . . . . 0.63 109.31 178.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.8 p -57.87 -41.39 82.34 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.403 -0.519 . . . . 0.96 111.205 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.86 -32.09 21.89 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.389 -0.597 . . . . 2.12 109.389 171.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.01 17.33 23.16 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.457 -0.792 . . . . 0.23 113.84 172.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.77 -44.36 77.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.253 0.526 . . . . 1.73 109.752 174.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.6 tttm -82.98 137.22 34.25 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.644 -0.872 . . . . 1.91 108.644 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.425 HG22 ' HG2' ' A' ' 30' ' ' ARG . 12.4 p -149.89 138.49 14.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.799 0.333 . . . . 1.04 111.432 -176.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -143.98 126.45 15.88 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.618 -0.512 . . . . 0.54 109.618 176.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.437 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 92.2 m -111.64 136.44 50.86 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.135 0.42 . . . . 1.04 112.135 -176.081 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.5 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.37 128.61 57.73 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.704 0 N-CA-C 108.154 -1.054 . . . . 1.04 108.154 169.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.425 ' O ' HG12 ' A' ' 45' ' ' ILE . 70.5 t -92.73 121.62 43.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 O-C-N 121.108 -0.995 . . . . 1.02 108.773 173.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.439 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -69.8 -17.08 63.39 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.923 0.712 . . . . 1.01 112.923 -169.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.9 p -72.04 -11.63 60.85 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.205 -0.598 . . . . 1.07 109.557 174.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 p -111.4 9.09 21.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.615 -0.721 . . . . 1.03 109.711 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.493 HG22 ' CD1' ' A' ' 62' ' ' LEU . 25.8 mm -113.33 141.49 28.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 108.963 -0.754 . . . . 1.01 108.963 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -107.08 -44.69 4.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.982 0.42 . . . . 0.52 110.489 -179.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.584 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 24.5 mtpp -133.0 172.16 13.0 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-O 121.711 0.767 . . . . 1.95 111.895 -175.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.568 ' HG ' ' C ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -153.28 138.93 17.84 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.332 -1.304 . . . . 1.39 108.284 178.414 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -137.23 118.56 14.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 117.736 0.244 . . . . 2.02 110.914 -173.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.459 ' HB3' ' SD ' ' A' ' 97' ' ' MET . . . -115.04 141.6 47.77 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.715 0.293 . . . . 1.05 111.358 -177.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.476 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 73.3 p -65.68 120.29 67.31 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 115.764 -0.653 . . . . 1.05 111.01 -176.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.55 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 10.4 Cg_exo -60.42 161.51 20.19 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.395 2.063 . . . . 0.44 111.54 176.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.09 -21.48 65.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 1.21 110.92 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.4 p -78.81 -18.17 54.52 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.917 -0.583 . . . . 1.94 110.614 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.55 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 37.8 m -75.93 139.53 41.64 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.701 -0.681 . . . . 1.13 111.143 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.36 -11.92 46.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.129 -0.941 . . . . 1.77 110.712 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.468 ' HG2' ' HE1' ' A' ' 59' ' ' MET . 9.5 mptt -102.5 155.39 18.3 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 114.748 -1.115 . . . . 2.18 111.783 -174.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.492 ' CE ' ' HE1' ' A' ' 97' ' ' MET . 71.9 mmm -130.77 99.38 4.92 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.359 -0.837 . . . . 1.11 109.296 170.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.514 ' HE2' ' SD ' ' A' ' 88' ' ' MET . 0.6 OUTLIER -156.06 157.65 36.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.751 -0.659 . . . . 1.05 111.674 -173.224 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.458 HD11 ' O ' ' A' ' 97' ' ' MET . 1.7 tt -132.01 119.31 20.89 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 108.353 -0.98 . . . . 1.05 108.353 176.249 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 88' ' ' MET . 54.9 mtm180 -101.62 140.58 35.72 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 120.849 0.357 . . . . 3.5 111.075 -178.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.537 HD22 HD11 ' A' ' 104' ' ' LEU . 1.3 mm? -116.72 105.25 12.2 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.429 -0.805 . . . . 1.03 109.403 175.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.584 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.5 mp -86.03 107.78 16.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 122.551 0.34 . . . . 1.11 110.317 -173.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.67 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -62.26 164.11 24.94 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.989 -0.624 . . . . 0.54 112.621 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -80.78 157.68 25.69 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.237 0.541 . . . . 1.08 111.687 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.439 HG22 ' HG3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -114.28 110.12 30.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 115.519 -0.764 . . . . 2.32 111.252 -177.492 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.67 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 36.6 m-20 -90.6 78.24 6.29 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 108.569 -0.9 . . . . 3.23 108.569 169.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -68.42 -1.29 6.17 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.128 0.418 . . . . 2.39 112.128 -171.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.0 p -67.33 -17.9 64.95 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.344 0.592 . . . . 3.2 109.789 169.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -78.65 32.65 0.2 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.41 -0.814 . . . . 2.95 111.183 178.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.0 mmmt -45.67 113.87 0.67 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.087 -0.708 . . . . 3.72 109.087 -175.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.535 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 36.0 ttm180 -105.55 165.49 11.11 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 115.78 -0.646 . . . . 4.12 109.289 -169.262 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.574 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 96.7 mttt -136.93 140.78 42.51 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.669 -0.493 . . . . 4.59 109.669 173.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -86.26 -165.04 1.14 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.221 -0.445 . . . . 4.41 110.587 -176.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -60.95 -30.83 70.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 5.69 111.317 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -82.95 -21.96 33.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.801 0.334 . . . . 5.38 110.739 -177.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.99 14.19 37.35 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.139 -0.784 . . . . 4.47 111.139 -175.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.574 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 80.0 m-20 -69.63 132.34 46.03 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 109.23 -0.655 . . . . 4.72 109.23 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -70.73 92.91 0.9 Allowed 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.348 -0.612 . . . . 4.28 109.348 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.535 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 17.4 m -101.22 98.62 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 CA-C-O 121.725 0.774 . . . . 3.51 109.418 177.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.438 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -85.65 102.69 2.76 Favored Pre-proline 0 C--N 1.314 -0.965 0 N-CA-C 108.366 -0.976 . . . . 2.87 108.366 175.229 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 46.5 Cg_exo -59.39 132.2 44.99 Favored 'Trans proline' 0 CA--C 1.516 -0.39 0 C-N-CA 123.357 2.705 . . . . 2.06 113.478 -165.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -73.76 165.45 53.08 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 114.189 -1.369 . . . . 3.13 109.988 178.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.67 ' HB3' ' O ' ' A' ' 64' ' ' GLY . 16.9 Cg_exo -61.23 147.88 94.39 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 121.842 1.695 . . . . 0.99 112.248 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -91.8 115.64 28.23 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.602 -0.726 . . . . 2.11 109.242 177.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.2 mtt-85 -100.21 120.54 40.05 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.388 -0.824 . . . . 3.17 110.123 -173.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.529 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 54.9 m-70 -95.48 111.0 22.98 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.432 -0.804 . . . . 0.72 108.96 -177.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.514 ' SD ' ' HE2' ' A' ' 59' ' ' MET . 30.5 ttm -107.51 125.76 51.68 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 119.795 -0.762 . . . . 1.07 111.254 -176.36 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -114.05 129.1 56.63 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.263 -0.88 . . . . 0.27 109.498 177.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.46 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.24 149.31 29.08 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.076 0.465 . . . . 1.68 110.275 178.041 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.408 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.7 m-85 -132.06 173.81 10.83 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.932 -0.576 . . . . 0.32 110.682 -175.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.566 ' C ' HD21 ' A' ' 93' ' ' ASN . 8.9 t-20 -123.11 -20.89 5.59 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.953 -0.567 . . . . 2.7 110.116 174.617 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.566 HD21 ' C ' ' A' ' 92' ' ' ASN . 0.9 OUTLIER -126.33 123.44 38.03 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.054 0.454 . . . . 1.16 110.786 -177.249 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.476 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 15.4 mmm180 -60.77 -33.31 72.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.504 -0.771 . . . . 3.7 112.654 179.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.8 m -64.38 -37.96 89.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.786 0.327 . . . . 1.13 110.819 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.615 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.4 t -66.23 -56.19 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 CA-C-N 116.299 -0.41 . . . . 1.06 110.489 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.492 ' HE1' ' CE ' ' A' ' 58' ' ' MET . 10.8 ptp -57.24 -39.28 75.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.97 -0.559 . . . . 1.02 110.828 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.476 ' N ' ' HG3' ' A' ' 97' ' ' MET . 32.4 t70 -66.63 -41.06 88.91 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 120.722 -0.391 . . . . 0.34 110.451 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -69.22 -44.11 72.72 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.114 0.259 . . . . 1.58 111.08 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 96' ' ' VAL . 31.7 mm -61.09 -57.76 10.67 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 108.81 -0.811 . . . . 1.01 108.81 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.526 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 29.5 ttpt -50.83 -48.39 59.91 Favored 'General case' 0 C--O 1.215 -0.75 0 O-C-N 123.927 0.767 . . . . 1.47 109.863 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.696 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 41.5 ttp -49.09 -56.99 7.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.716 -0.674 . . . . 1.02 111.077 177.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.722 ' O ' HG13 ' A' ' 107' ' ' ILE . 26.0 m -58.72 -51.96 67.73 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.468 0.48 . . . . 1.04 110.473 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.537 HD11 HD22 ' A' ' 62' ' ' LEU . 29.1 mt -48.48 -54.03 15.76 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 123.451 0.701 . . . . 1.04 110.613 175.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.534 ' HG2' HD12 ' A' ' 48' ' ' LEU . 44.9 mt-30 -50.56 -44.99 56.83 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.701 -1.136 . . . . 1.96 111.825 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.696 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.9 mt-30 -63.29 -42.21 99.06 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 122.001 0.905 . . . . 3.11 108.986 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.722 HG13 ' O ' ' A' ' 103' ' ' THR . 10.2 mt -66.1 -45.98 89.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 114.1 -1.409 . . . . 1.03 111.311 -178.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 104' ' ' LEU . 9.0 mt -64.21 -40.77 90.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.218 -0.446 . . . . 1.04 111.493 -178.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.4 t -58.54 -23.3 57.98 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.383 -0.371 . . . . 1.67 110.965 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -66.1 -52.14 51.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.427 0.632 . . . . 1.99 109.652 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -79.01 -11.67 60.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.475 -0.784 . . . . 1.0 110.441 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.95 -40.51 75.41 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.747 -0.834 . . . . 1.46 108.747 173.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -74.05 -39.55 63.44 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.327 -0.851 . . . . 2.27 109.98 175.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -95.17 55.49 1.79 Allowed 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.134 -0.939 . . . . 1.47 110.478 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 C--O 1.248 0.997 0 CA-C-N 115.445 -0.798 . . . . 2.72 110.897 -177.777 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.642 0 N-CA-C 111.898 -0.481 . . . . 20.26 111.898 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 520' ' ' SER . . . . . 0.692 ' HB2' ' HH ' ' B' ' 523' ' ' TYR . 24.9 m -121.12 95.72 48.63 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 109.889 -0.412 . . . . 18.54 109.889 178.753 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -73.65 -12.05 24.36 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 123.162 2.575 . . . . 17.79 113.99 -174.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -147.29 141.94 9.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.063 -1.065 . . . . 16.44 113.047 -177.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . 0.692 ' HH ' ' HB2' ' B' ' 520' ' ' SER . 84.4 m-85 -129.6 87.33 53.13 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.759 -0.46 . . . . 16.12 109.759 176.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -59.82 -57.32 0.85 Allowed 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.97 2.447 . . . . 13.81 112.396 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 54.58 65.69 1.44 Allowed 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.568 0.543 . . . . 12.88 111.583 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -147.17 -74.25 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.893 -0.67 . . . . 9.73 111.792 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . 0.459 ' N ' HD13 ' B' ' 527' ' ' LEU . 0.0 OUTLIER -132.44 29.17 4.28 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.73 0.3 . . . . 8.74 111.217 177.303 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 2.7 tt -73.08 85.24 1.32 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.957 -0.757 . . . . 10.79 108.957 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 66.7 m 60.85 63.57 1.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.652 -0.704 . . . . 7.62 110.122 -177.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -59.82 -63.33 5.18 Favored Glycine 0 N--CA 1.449 -0.481 0 CA-C-N 115.13 -0.941 . . . . 5.26 112.514 -177.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -158.25 -41.55 0.06 Allowed 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.751 0.786 . . . . 5.5 110.409 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -80.09 -45.21 18.65 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.637 -1.165 . . . . 5.68 109.956 -176.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -72.58 -26.31 61.66 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 113.171 -1.831 . . . . 3.22 110.074 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -75.63 -45.3 38.14 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.374 -0.83 . . . . 5.14 110.702 -176.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 7.8 p -65.67 -30.6 71.32 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.882 -0.599 . . . . 1.34 111.269 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 18.2 m -71.49 -36.34 71.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 2.43 111.029 177.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 7.5 mm -77.64 -37.53 24.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.897 0.38 . . . . 1.69 110.868 175.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -75.15 5.58 5.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.6 0.714 . . . . 1.36 110.934 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -69.68 -40.04 76.6 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.113 -0.949 . . . . 1.23 108.718 167.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 50.7 mtm -67.08 -29.7 69.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 114.869 -1.059 . . . . 2.83 110.036 174.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -67.3 -53.75 26.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.515 0.674 . . . . 1.18 109.836 176.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.56 -34.32 77.55 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.692 -1.14 . . . . 0.66 111.322 -173.611 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 22.5 t -64.1 -24.21 67.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.028 -0.533 . . . . 2.08 110.737 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -91.5 -14.47 30.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.995 0.426 . . . . 1.34 110.802 177.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 78.2 mt -82.18 -40.29 21.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.229 -0.442 . . . . 1.82 111.498 -178.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 20.8 mt -76.26 -22.08 55.55 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.274 0.559 . . . . 1.54 110.026 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 36.1 p -96.96 33.38 1.91 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.291 -0.868 . . . . 1.92 111.554 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -76.8 44.8 0.39 Allowed 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.393 0.616 . . . . 3.31 110.543 175.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 26.2 pt -102.5 3.86 10.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.617 -0.72 . . . . 5.68 110.94 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 22.9 m -102.71 14.54 31.69 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.263 0.554 . . . . 6.4 110.214 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 C--O 1.248 0.987 0 CA-C-N 115.518 -0.765 . . . . 7.59 109.686 177.756 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo . . . . . 0 N--CA 1.479 0.658 0 N-CA-C 111.191 -0.35 . . . . 2.47 111.191 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.2 t -160.04 105.79 1.56 Allowed 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 109.012 -0.736 . . . . 2.05 109.012 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.499 ' HA ' HD12 ' A' ' 18' ' ' ILE . 76.4 m80 -95.68 1.37 53.48 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.023 -0.535 . . . . 1.08 110.734 -178.647 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 t -152.53 149.08 28.12 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 118.885 -1.126 . . . . 1.78 113.928 -170.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.477 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -169.28 -172.13 35.65 Favored Glycine 0 N--CA 1.439 -1.111 0 CA-C-N 113.668 -1.605 . . . . 0.16 109.745 177.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -91.53 132.38 36.32 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 117.834 0.817 . . . . 1.04 110.323 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.426 ' HB2' ' HB3' ' A' ' 89' ' ' PHE . . . -144.12 146.6 32.89 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.196 -0.456 . . . . 1.02 111.435 -177.728 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.503 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 98.3 mt -107.47 123.75 62.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.281 -0.418 . . . . 1.17 110.706 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.457 ' O ' HG11 ' A' ' 12' ' ' VAL . 20.0 t80 -127.19 137.54 52.95 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.305 -0.998 . . . . 0.43 108.305 177.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 58.35 26.24 13.8 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 122.775 0.43 . . . . 0.8 110.919 -178.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.4 mtmm 68.61 0.08 2.49 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.521 0.728 . . . . 2.57 112.915 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.457 HG11 ' O ' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -92.4 116.82 34.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 108.53 -0.915 . . . . 1.1 108.53 169.014 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.41 ' HA ' HG12 ' A' ' 8' ' ' ILE . 50.2 p -70.92 145.18 50.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.114 0.483 . . . . 1.5 110.791 -176.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.0 -160.42 10.7 Favored Glycine 0 N--CA 1.436 -1.366 0 C-N-CA 120.297 -0.954 . . . . 0.12 113.087 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 23.0 mm -125.27 132.28 71.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.122 -0.695 . . . . 1.02 109.122 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.439 HD13 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -100.82 136.1 33.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 N-CA-C 109.856 -0.424 . . . . 1.05 109.856 -176.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.9 125.83 24.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.921 0.391 . . . . 1.04 111.523 -179.689 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.5 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 74.5 mt -85.28 132.8 30.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.779 -0.452 . . . . 1.04 109.779 177.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -102.98 102.29 12.33 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.967 -0.56 . . . . 1.98 110.792 -174.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.432 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 13.5 mt-10 -116.02 170.16 8.7 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.256 -0.646 . . . . 1.2 109.256 176.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.432 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 35.5 t70 78.21 -4.59 2.18 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 122.394 1.092 . . . . 0.58 109.704 -176.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.661 HG23 ' O ' ' A' ' 23' ' ' SER . 32.5 m -103.15 -172.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-N 113.765 -1.561 . . . . 1.05 110.028 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.661 ' O ' HG23 ' A' ' 22' ' ' VAL . 58.2 m -72.89 169.65 16.65 Favored Pre-proline 0 C--N 1.315 -0.898 0 N-CA-C 105.686 -1.968 . . . . 1.77 105.686 173.613 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -41.96 129.21 4.19 Favored 'Trans proline' 0 C--N 1.359 1.126 0 CA-C-N 121.538 1.585 . . . . 0.19 112.328 -145.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -55.97 141.99 37.52 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 114.262 -1.335 . . . . 1.03 112.051 -161.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -123.47 168.94 11.9 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.568 -1.196 . . . . 0.32 111.915 -169.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.49 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.2 tm? -120.08 105.28 10.86 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 107.69 -1.226 . . . . 1.02 107.69 173.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.2 m -100.91 106.81 18.19 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 116.554 -0.294 . . . . 1.02 110.854 -176.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.4 ' HZ2' ' O ' ' A' ' 12' ' ' VAL . 83.8 t90 -85.07 130.41 34.62 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.98 -0.748 . . . . 0.17 108.98 171.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 58.0 mtt180 -126.46 155.2 42.62 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.067 -0.716 . . . . 2.24 109.067 174.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -69.0 176.19 3.29 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 109.634 -0.506 . . . . 0.63 109.634 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.7 p -61.24 -32.42 72.21 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.224 -0.59 . . . . 0.96 110.272 177.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -86.65 -31.64 20.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.674 0.749 . . . . 2.12 108.981 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.445 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 88.62 9.97 68.16 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.573 -1.194 . . . . 0.23 112.498 176.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -64.14 -48.42 76.13 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.795 -0.817 . . . . 1.73 108.795 173.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -77.35 136.1 38.42 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.284 -0.871 . . . . 1.91 109.134 173.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.414 HG21 ' HG2' ' A' ' 30' ' ' ARG . 11.6 p -150.15 139.24 15.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 120.739 0.304 . . . . 1.04 111.089 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -144.47 121.43 11.35 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.659 -0.497 . . . . 0.54 109.659 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.432 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 32.3 m -109.47 133.23 53.34 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.194 0.442 . . . . 1.04 112.194 -175.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.11 129.23 53.81 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.702 0 N-CA-C 108.253 -1.017 . . . . 1.04 108.253 169.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.4 t -92.92 121.77 43.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 O-C-N 121.036 -1.04 . . . . 1.02 108.769 173.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.408 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -68.67 -20.88 64.46 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.151 0.797 . . . . 1.01 113.151 -169.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.1 p -68.62 -14.56 63.09 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.159 -0.616 . . . . 1.07 109.735 174.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.3 p -111.1 14.86 21.84 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.568 -0.742 . . . . 1.03 109.703 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.449 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 24.1 mm -113.08 138.73 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 115.641 -0.709 . . . . 1.01 109.217 176.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -104.15 -40.53 6.12 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.204 -0.453 . . . . 0.52 110.51 -176.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.444 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 11.2 mtmm -141.62 170.64 15.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.325 -0.398 . . . . 1.95 110.93 -177.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.492 HD11 HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -149.69 141.66 23.84 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.498 -0.927 . . . . 1.39 108.498 176.871 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.473 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 18.0 mm-40 -136.77 114.7 11.38 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 117.362 0.074 . . . . 2.02 111.069 -171.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.42 ' HB1' ' HD3' ' A' ' 101' ' ' LYS . . . -113.34 142.72 45.53 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.98 -0.45 . . . . 1.05 111.229 -179.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.573 ' N ' ' HZ ' ' B' ' 542' ' ' PHE . 34.8 p -62.01 122.32 71.44 Favored Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 115.822 -0.626 . . . . 1.05 110.985 -176.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.536 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 15.1 Cg_exo -59.21 159.6 21.97 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.554 2.169 . . . . 0.44 111.303 177.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.19 -14.81 63.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 1.21 110.857 -179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 p -85.84 -17.19 36.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.631 -0.713 . . . . 1.94 110.845 176.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.536 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 45.2 m -78.73 135.67 37.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.717 -0.674 . . . . 1.13 111.133 -179.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -56.44 -34.44 66.84 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.333 -0.849 . . . . 1.77 110.061 172.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.505 ' HG2' ' HE3' ' A' ' 59' ' ' MET . 8.3 mptt -76.25 152.12 36.61 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 113.992 -1.458 . . . . 2.18 111.927 -174.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.445 ' HE2' ' HE2' ' A' ' 97' ' ' MET . 85.7 mmm -129.48 98.55 4.89 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.304 -0.862 . . . . 1.11 108.691 171.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.505 ' HE3' ' HG2' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -154.07 153.84 32.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.882 -0.599 . . . . 1.05 111.53 -172.069 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 97' ' ' MET . 1.8 tt -130.33 118.91 21.99 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.342 -0.984 . . . . 1.05 108.342 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.634 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 1.6 mtp180 -103.41 149.21 25.02 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.458 0.647 . . . . 3.5 111.775 -178.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.536 ' HB2' ' HB2' ' A' ' 87' ' ' HIS . 1.4 mm? -127.65 104.98 8.16 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.38 -1.282 . . . . 1.03 108.901 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.56 HD11 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -88.3 105.0 15.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 110.196 -0.298 . . . . 1.11 110.196 -173.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.563 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -62.69 160.45 33.37 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 116.181 -0.463 . . . . 0.54 112.464 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.449 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.2 mttt -81.62 115.04 20.71 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.654 0.74 . . . . 1.08 112.664 -177.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.634 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 2.3 t -122.35 133.2 69.32 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-N 114.465 -1.243 . . . . 2.32 109.65 170.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.793 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 20.9 t70 -89.5 87.87 7.23 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.701 -0.681 . . . . 3.23 109.208 178.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.61 -4.52 4.23 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.865 0.691 . . . . 2.39 112.865 -170.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.57 -1.65 47.1 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.092 0.472 . . . . 3.2 110.673 172.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.793 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.2 ptmt -81.39 40.14 0.55 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.92 -0.582 . . . . 2.95 110.331 172.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.486 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 25.1 mmtm -43.53 114.32 0.62 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.705 -0.68 . . . . 3.72 110.665 -173.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.567 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 44.9 ttt180 -95.57 162.92 13.43 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 108.093 -1.077 . . . . 4.12 108.093 -175.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.564 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 20.0 mtpt -128.29 132.81 48.67 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.182 -0.673 . . . . 4.59 109.182 172.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -77.37 -171.92 2.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.63 -0.713 . . . . 4.41 110.696 -174.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -59.52 -32.05 69.94 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.775 0.287 . . . . 5.69 111.775 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.492 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 25.0 mt-10 -83.71 -19.06 35.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.031 0.443 . . . . 5.38 110.926 -179.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.434 ' O ' ' HE2' ' A' ' 73' ' ' LYS . . . 95.89 31.19 7.48 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.953 -0.567 . . . . 4.47 112.753 178.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.564 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 39.7 m-80 -92.35 148.17 22.34 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.046 -0.724 . . . . 4.72 109.046 175.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -72.55 89.38 1.28 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.11 0.481 . . . . 4.28 109.778 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.567 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 12.3 m -99.36 99.31 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.983 0 CA-C-O 121.884 0.849 . . . . 3.51 109.076 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.486 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.4 OUTLIER -85.22 119.38 72.33 Favored Pre-proline 0 C--N 1.31 -1.121 0 CA-C-N 115.601 -0.727 . . . . 2.87 109.994 -178.597 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 52.8 Cg_exo -58.25 140.93 96.18 Favored 'Trans proline' 0 CA--C 1.513 -0.573 0 C-N-CA 122.638 2.225 . . . . 2.06 112.274 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.73 148.6 35.1 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 115.587 -0.733 . . . . 3.13 109.156 177.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.634 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 22.8 Cg_exo -62.73 148.22 93.68 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.249 1.966 . . . . 0.99 110.686 176.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -84.26 114.39 21.8 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.6 0.714 . . . . 2.11 109.944 -176.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.507 ' HG2' HG13 ' A' ' 63' ' ' ILE . 90.3 mtt180 -104.15 121.75 43.9 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 115.182 -0.917 . . . . 3.17 110.497 -172.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.573 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 80.3 m-70 -94.76 146.28 24.28 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 107.415 -1.328 . . . . 0.72 107.415 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.634 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 8.1 ttm -141.1 125.49 17.6 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 119.049 0.84 . . . . 1.07 110.931 176.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.426 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 6.6 m-85 -116.84 127.95 54.79 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.356 -0.838 . . . . 0.27 109.654 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.503 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -80.93 150.72 28.88 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.717 0.294 . . . . 1.68 110.356 178.222 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.42 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 28.2 m-85 -133.46 175.47 9.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.515 0.674 . . . . 0.32 111.649 -174.044 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -111.24 -29.44 7.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.952 -1.022 . . . . 2.7 110.998 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -138.13 142.89 40.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.003 0.43 . . . . 1.16 110.502 -177.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.56 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 11.0 mmm180 -64.99 -34.23 77.94 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.48 -0.782 . . . . 3.7 111.011 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 57.0 m -58.74 -39.28 80.45 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.115 -0.493 . . . . 1.13 110.626 -176.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.556 ' O ' HG12 ' A' ' 100' ' ' ILE . 9.7 t -67.15 -55.91 15.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.184 -0.462 . . . . 1.06 110.026 177.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.56 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 14.0 ptp -61.86 -41.34 97.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 1.02 111.237 -177.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.427 ' N ' ' HG3' ' A' ' 97' ' ' MET . 36.4 t70 -62.34 -37.1 84.36 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.394 -0.522 . . . . 0.34 110.504 178.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -74.08 -43.46 57.62 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.332 -0.395 . . . . 1.58 111.618 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.561 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 30.8 mm -63.71 -55.02 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 N-CA-C 108.962 -0.755 . . . . 1.01 108.962 176.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.493 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 29.8 ttpt -51.53 -45.48 62.98 Favored 'General case' 0 C--O 1.217 -0.609 0 O-C-N 123.574 0.546 . . . . 1.47 109.783 177.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.618 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 38.8 ttp -50.91 -59.8 3.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.839 -0.619 . . . . 1.02 111.308 177.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.793 ' O ' HG13 ' A' ' 107' ' ' ILE . 27.6 m -56.5 -49.77 73.75 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 123.471 0.482 . . . . 1.04 110.263 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 30.9 mt -48.48 -55.32 11.28 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 123.026 0.53 . . . . 1.04 110.579 174.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.493 ' HG3' ' O ' ' A' ' 101' ' ' LYS . 45.0 mt-30 -54.22 -42.41 69.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.141 -0.936 . . . . 1.96 111.712 176.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.618 ' HG3' ' O ' ' A' ' 102' ' ' MET . 21.4 mt-30 -64.71 -28.64 69.73 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.769 0.795 . . . . 3.11 109.457 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.793 HG13 ' O ' ' A' ' 103' ' ' THR . 10.7 mt -84.52 -45.34 17.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.672 -1.149 . . . . 1.03 111.232 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.5 HG13 ' O ' ' A' ' 104' ' ' LEU . 9.8 mt -63.24 -38.81 83.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.28 -0.418 . . . . 1.04 111.582 -177.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.409 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 4.7 p -57.75 -26.87 62.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.41 -0.359 . . . . 1.67 111.351 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -62.6 -47.18 84.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.413 0.625 . . . . 1.99 109.557 174.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -89.67 8.18 32.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.548 -0.751 . . . . 1.0 110.186 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.409 ' CB ' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER -95.53 -16.56 22.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.631 -0.877 . . . . 1.46 108.631 176.07 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -75.5 -37.66 60.02 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 107.977 -1.119 . . . . 2.27 107.977 167.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.23 -23.69 59.2 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 113.978 -1.464 . . . . 1.47 110.605 -179.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.417 ' OD2' ' HE2' ' A' ' 65' ' ' LYS . 9.0 t70 . . . . . 0 C--O 1.248 0.978 0 CA-C-N 114.637 -1.165 . . . . 2.72 110.371 -178.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.775 0 N-CA-C 111.959 -0.457 . . . . 20.26 111.959 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 43.8 t -94.9 123.31 58.02 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.627 0.214 . . . . 18.54 110.468 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -81.65 6.17 5.82 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.761 2.308 . . . . 17.79 111.757 175.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 92.97 157.78 33.81 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.773 -0.649 . . . . 16.44 111.688 -177.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -117.78 95.82 48.52 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-O 120.522 0.201 . . . . 16.12 110.709 -178.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.2 151.25 54.68 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.49 2.126 . . . . 13.81 111.615 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -94.16 143.8 26.06 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.445 -0.343 . . . . 12.88 110.95 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -93.59 50.58 2.34 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.813 -0.708 . . . . 9.73 111.927 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 2.7 pp -139.14 122.09 16.68 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.094 0.473 . . . . 8.74 110.131 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . 0.414 ' H ' ' HB2' ' B' ' 533' ' ' ASP . 44.3 tp -98.53 -8.58 26.32 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.554 -1.276 . . . . 10.79 107.554 167.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 529' ' ' SER . . . . . 0.467 ' OG ' ' HB2' ' B' ' 532' ' ' GLU . 25.0 p -172.69 -31.99 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 112.939 -1.937 . . . . 7.62 107.314 178.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 150.48 -74.88 0.26 Allowed Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 114.912 -1.04 . . . . 5.26 112.828 168.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -99.15 -10.85 21.97 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 122.204 1.002 . . . . 5.5 108.905 -174.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . 0.515 ' HA ' ' OG ' ' B' ' 535' ' ' SER . 49.4 mt-10 -90.01 4.88 48.84 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.034 -1.439 . . . . 5.68 110.361 -178.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . 0.414 ' HB2' ' H ' ' B' ' 528' ' ' LEU . 13.2 t70 -89.87 -43.81 10.36 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.063 -1.426 . . . . 3.22 109.949 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -66.51 -39.61 88.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.689 0.757 . . . . 5.14 109.667 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 535' ' ' SER . . . . . 0.515 ' OG ' ' HA ' ' B' ' 532' ' ' GLU . 9.4 p -71.63 -11.13 60.69 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.949 -1.023 . . . . 1.34 110.496 176.41 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 536' ' ' SER . . . . . 0.473 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 26.4 t -75.2 -27.52 59.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.17 0.51 . . . . 2.43 109.781 176.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . 0.453 ' O ' ' HB2' ' B' ' 540' ' ' MET . 22.2 mm -80.93 -31.14 12.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.476 -0.564 . . . . 1.69 109.476 172.377 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -76.18 -3.14 34.67 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.723 0.773 . . . . 1.36 110.097 172.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.473 ' HB3' ' O ' ' B' ' 536' ' ' SER . 22.2 t70 -80.69 -32.53 35.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.978 -1.01 . . . . 1.23 108.725 173.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 540' ' ' MET . . . . . 0.453 ' HB2' ' O ' ' B' ' 537' ' ' ILE . 84.5 mmm -57.83 -30.13 65.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.359 -1.291 . . . . 2.83 110.41 176.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -62.24 -43.83 97.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.33 -0.85 . . . . 1.18 110.408 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.573 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -63.52 -34.33 77.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.229 -0.896 . . . . 0.66 111.52 -173.479 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 16.9 t -60.28 -29.18 68.65 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.759 -0.655 . . . . 2.08 110.806 -177.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -85.27 -18.84 32.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.318 -0.401 . . . . 1.34 111.027 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 92.2 mt -84.12 -41.95 16.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.965 0.412 . . . . 1.82 111.611 -177.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . 0.409 HD13 ' HB3' ' A' ' 49' ' ' GLN . 18.1 mt -76.86 -22.36 53.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.238 0.542 . . . . 1.54 110.522 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 19.4 m -89.54 -61.24 1.74 Allowed 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.341 -0.845 . . . . 1.92 110.42 176.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 47.84 56.74 6.78 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.325 0.583 . . . . 3.31 111.744 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 1.4 tp -103.08 -37.81 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.058 0 CA-C-N 115.583 -0.735 . . . . 5.68 109.725 175.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 17.0 m -119.53 40.3 3.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.025 -0.534 . . . . 6.4 110.603 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 33.8 m . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.706 -0.664 . . . . 7.59 110.572 -177.411 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo . . . . . 0 N--CA 1.472 0.255 0 N-CA-C 110.992 -0.426 . . . . 2.47 110.992 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.8 m -69.84 -28.19 65.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.525 . . . . 2.05 111.409 -177.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.571 ' HA ' HD11 ' A' ' 18' ' ' ILE . 77.8 m80 65.07 -3.21 0.63 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.835 0.68 . . . . 1.08 112.835 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.3 t -156.74 159.17 38.07 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 119.773 -0.771 . . . . 1.78 112.131 -174.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.512 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.18 -168.82 39.78 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 114.478 -1.237 . . . . 0.16 110.099 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.7 131.93 39.99 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 117.49 0.645 . . . . 1.04 110.398 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.406 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -142.36 144.82 33.35 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.133 0.492 . . . . 1.02 111.561 -177.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.6 mt -111.52 119.45 59.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.883 -0.599 . . . . 1.17 110.258 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -120.65 137.37 54.49 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.717 -0.846 . . . . 0.43 108.717 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 54.74 26.57 7.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 122.737 0.415 . . . . 0.8 111.019 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp 68.37 5.34 4.7 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.825 0.676 . . . . 2.57 112.825 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.5 p -94.9 116.54 36.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 108.216 -1.031 . . . . 1.1 108.216 166.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.9 m -73.0 144.71 47.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.023 0.439 . . . . 1.5 111.077 -175.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.0 -158.43 9.32 Favored Glycine 0 N--CA 1.437 -1.257 0 C-N-CA 120.686 -0.769 . . . . 0.12 112.803 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -125.95 134.62 66.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.184 -0.673 . . . . 1.02 109.184 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.448 HD11 HD11 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.14 135.34 39.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.983 -0.377 . . . . 1.05 109.983 -177.053 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.75 127.86 27.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.948 0.404 . . . . 1.04 111.518 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.571 HD11 ' HA ' ' A' ' 3' ' ' HIS . 65.6 mt -86.02 133.75 28.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.169 -0.469 . . . . 1.04 109.94 177.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -106.31 102.01 11.45 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.822 -0.626 . . . . 1.98 110.784 -174.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -116.28 169.35 9.36 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.189 -0.671 . . . . 1.2 109.189 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t70 76.7 -2.23 2.73 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 122.413 1.101 . . . . 0.58 109.737 -176.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' ' 23' ' ' SER . 33.3 m -103.47 -173.71 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 113.743 -1.572 . . . . 1.05 109.959 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.636 ' O ' HG23 ' A' ' 22' ' ' VAL . 59.5 m -72.96 168.56 23.48 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 105.306 -2.109 . . . . 1.77 105.306 173.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.683 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 72.9 Cg_exo -40.7 128.32 2.58 Favored 'Trans proline' 0 C--N 1.356 0.941 0 CA-C-N 121.55 1.589 . . . . 0.19 112.821 -143.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.86 140.08 25.36 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 114.357 -1.292 . . . . 1.03 112.039 -164.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -126.47 168.92 13.56 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.597 -1.183 . . . . 0.32 112.076 -168.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.491 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.1 tm? -120.25 104.24 9.9 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 107.375 -1.343 . . . . 1.02 107.375 174.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.7 m -101.69 107.87 19.23 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.07 0.462 . . . . 1.02 111.116 -176.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -85.1 131.78 34.4 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.973 -0.751 . . . . 0.17 108.973 172.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.434 ' HG2' HG22 ' A' ' 37' ' ' VAL . 96.3 mtt180 -126.2 158.15 36.38 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.156 -0.683 . . . . 2.24 109.156 173.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -69.73 174.55 5.02 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.226 -0.657 . . . . 0.63 109.226 178.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.6 p -60.96 -35.52 76.97 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 119.93 -0.708 . . . . 0.96 110.504 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -85.58 -29.34 24.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.613 0.721 . . . . 2.12 109.5 173.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.404 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 90.78 16.76 54.08 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 114.843 -1.072 . . . . 0.23 112.68 175.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -69.1 -51.41 38.82 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.954 -0.758 . . . . 1.73 108.954 173.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.8 tttt -75.72 136.01 40.35 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.9 -0.778 . . . . 1.91 108.9 173.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.434 HG22 ' HG2' ' A' ' 30' ' ' ARG . 14.0 p -149.75 134.82 10.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 120.826 0.346 . . . . 1.04 111.047 -177.095 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -143.87 121.09 11.53 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.977 -0.379 . . . . 0.54 109.977 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 60.9 m -111.04 137.05 49.15 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.365 0.505 . . . . 1.04 112.365 -174.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.491 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.85 130.18 56.27 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.668 0 N-CA-C 108.392 -0.966 . . . . 1.04 108.392 170.559 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.0 t -92.55 119.7 40.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 O-C-N 121.005 -1.059 . . . . 1.02 108.854 173.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.4 HD12 HD23 ' A' ' 104' ' ' LEU . 2.8 mm? -67.05 -22.82 65.85 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.662 0.615 . . . . 1.01 112.662 -170.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.683 ' OG ' ' HB3' ' A' ' 24' ' ' PRO . 9.7 m -63.87 -18.39 64.12 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.57 0.7 . . . . 1.07 109.482 175.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.1 p -113.72 17.83 17.87 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.164 -0.925 . . . . 1.03 110.034 -177.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.522 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 23.9 mm -113.95 140.82 32.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.896 -0.779 . . . . 1.01 108.896 176.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -102.4 -43.48 5.66 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.897 0.379 . . . . 0.52 110.555 -176.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.468 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 17.2 mtmm -141.81 173.04 11.88 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.086 -0.507 . . . . 1.95 110.988 -177.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.544 HD12 ' CG ' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -151.57 148.63 28.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.621 -0.718 . . . . 1.39 109.148 179.833 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.67 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -133.6 153.22 51.83 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 110.391 -0.226 . . . . 2.02 110.391 -174.872 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.423 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . . . -150.46 140.18 21.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.642 0.258 . . . . 1.05 110.785 176.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.431 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 40.9 p -66.3 118.06 49.52 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.614 -0.721 . . . . 1.05 110.653 -177.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.43 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 12.7 Cg_exo -57.0 159.31 15.03 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.761 2.307 . . . . 0.44 111.897 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.44 -15.92 63.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.195 -0.457 . . . . 1.21 111.316 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.7 m -83.53 -18.57 37.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.232 0.539 . . . . 1.94 110.998 175.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.43 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 73.2 m -79.29 138.31 37.7 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.492 -0.776 . . . . 1.13 111.585 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -62.3 -30.89 71.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.244 -0.889 . . . . 1.77 110.317 174.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.548 ' HE3' ' OD2' ' B' ' 541' ' ' ASP . 1.9 mptp? -77.35 153.01 34.18 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 114.183 -1.371 . . . . 2.18 111.64 -175.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.433 ' O ' ' HG3' ' A' ' 59' ' ' MET . 1.0 OUTLIER -129.3 98.5 4.9 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.886 -1.052 . . . . 1.11 108.639 172.052 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.474 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.1 OUTLIER -154.64 159.7 40.97 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.351 0.595 . . . . 1.05 111.878 -173.687 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.461 HD11 ' O ' ' A' ' 97' ' ' MET . 1.6 tt -140.96 119.31 12.17 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.69 -1.141 . . . . 1.05 108.416 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.67 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 25.5 mtp180 -103.7 136.68 42.95 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 121.285 0.565 . . . . 3.5 110.863 -179.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.554 ' HB2' ' HB2' ' A' ' 87' ' ' HIS . 1.2 mm? -111.51 104.39 12.8 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.601 -0.727 . . . . 1.03 109.197 176.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.566 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.7 mp -86.53 101.85 11.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.946 -0.39 . . . . 1.11 109.946 -174.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.512 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -61.49 163.97 21.45 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.783 -0.644 . . . . 0.54 112.784 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.522 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 82.0 mttt -85.2 108.94 17.97 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-O 121.954 0.883 . . . . 1.08 112.816 -177.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.563 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 11.9 t -124.68 127.3 72.69 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.611 0 CA-C-N 114.067 -1.424 . . . . 2.32 108.703 165.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.66 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 1.9 t70 -95.06 91.34 6.3 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 108.577 -0.897 . . . . 3.23 108.577 176.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.6 -7.61 3.51 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.881 0.697 . . . . 2.39 112.881 -168.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.421 ' C ' ' H ' ' A' ' 71' ' ' LYS . 82.6 p -64.49 -19.47 65.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.306 0.574 . . . . 3.2 109.567 172.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.66 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.1 ptmt -76.41 40.49 0.22 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.382 -0.826 . . . . 2.95 110.978 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.497 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 19.4 mmtm -44.21 113.48 0.54 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.508 -0.553 . . . . 3.72 109.508 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 50.4 ttt180 -94.97 156.23 16.41 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.733 -0.84 . . . . 4.12 108.733 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -130.36 134.62 47.3 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 121.333 0.587 . . . . 4.59 110.753 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -74.98 174.0 9.92 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.79 -1.096 . . . . 4.41 110.157 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -51.94 -32.05 31.44 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.774 0.657 . . . . 5.69 112.774 -174.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -87.66 7.56 29.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.696 0.284 . . . . 5.38 111.428 -177.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.11 10.96 85.62 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.944 -0.646 . . . . 4.47 112.011 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -72.08 131.62 43.09 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.342 -0.614 . . . . 4.72 109.342 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -70.01 113.18 6.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.988 0.423 . . . . 4.28 110.171 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 3.7 m -126.88 98.68 4.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 108.62 -0.882 . . . . 3.51 108.62 176.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.497 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.6 p -97.17 124.67 48.57 Favored Pre-proline 0 C--N 1.311 -1.08 0 CA-C-N 115.63 -0.714 . . . . 2.87 111.045 -171.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.495 ' O ' HG11 ' A' ' 66' ' ' VAL . 48.4 Cg_exo -59.08 132.52 47.62 Favored 'Trans proline' 0 CA--C 1.513 -0.536 0 C-N-CA 123.0 2.467 . . . . 2.06 112.707 -177.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -96.18 139.23 21.66 Favored Pre-proline 0 N--CA 1.432 -1.361 0 CA-C-N 114.869 -1.059 . . . . 3.13 109.908 175.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.563 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 22.1 Cg_exo -61.72 146.5 96.64 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 121.798 1.665 . . . . 0.99 110.611 176.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -86.01 112.48 21.26 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.339 -0.545 . . . . 2.11 110.243 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.537 ' HG2' HG13 ' A' ' 63' ' ' ILE . 44.7 mtm180 -105.11 112.66 25.88 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-O 121.497 0.665 . . . . 3.17 110.847 -174.128 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.554 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 58.3 m-70 -96.84 109.92 22.52 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.145 -0.934 . . . . 0.72 109.677 -175.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.59 ' HB2' ' HG2' ' A' ' 61' ' ' ARG . 14.5 ttm -106.43 120.69 42.55 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 119.768 -0.773 . . . . 1.07 110.738 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 59' ' ' MET . 6.9 m-85 -111.46 130.62 55.66 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.075 -0.966 . . . . 0.27 109.524 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.474 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.15 153.82 27.06 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.358 -0.608 . . . . 1.68 109.358 174.912 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.403 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 17.3 m-85 -131.27 172.93 11.58 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.436 0.636 . . . . 0.32 111.915 -174.159 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -109.44 -22.48 11.99 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.623 -1.171 . . . . 2.7 110.833 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.403 ' HB2' HG23 ' A' ' 96' ' ' VAL . 48.5 m-80 -144.55 134.88 24.36 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.55 0.691 . . . . 1.16 111.457 -176.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 12.2 mmm180 -59.32 -40.32 85.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.533 -1.212 . . . . 3.7 112.593 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.455 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 28.8 m -62.21 -34.97 77.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.79 0.329 . . . . 1.13 110.758 -178.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.597 ' O ' HG12 ' A' ' 100' ' ' ILE . 17.3 t -66.17 -57.1 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.415 0 CA-C-N 116.308 -0.406 . . . . 1.06 110.476 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.461 ' O ' HD11 ' A' ' 60' ' ' LEU . 10.4 ptp -58.22 -40.23 81.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.034 -0.53 . . . . 1.02 111.016 -177.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.429 ' O ' ' HB2' ' A' ' 102' ' ' MET . 26.1 t70 -65.7 -41.38 92.43 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.418 -0.513 . . . . 0.34 110.086 178.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 95' ' ' THR . 1.7 t-20 -68.3 -44.3 75.75 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.178 0.299 . . . . 1.58 111.336 -179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.597 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.6 mm -61.51 -56.95 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 N-CA-C 108.684 -0.858 . . . . 1.01 108.684 178.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.47 ' HE3' ' NE2' ' A' ' 105' ' ' GLN . 30.6 ttpt -50.08 -49.94 49.73 Favored 'General case' 0 C--O 1.217 -0.632 0 O-C-N 124.052 0.845 . . . . 1.47 109.821 176.589 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.568 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 49.9 ttp -49.26 -53.33 22.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.406 -0.815 . . . . 1.02 111.289 178.014 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.685 ' O ' HG13 ' A' ' 107' ' ' ILE . 20.7 m -61.03 -54.93 38.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.178 -0.464 . . . . 1.04 110.378 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.547 HD12 HD21 ' A' ' 62' ' ' LEU . 23.6 mt -46.72 -53.73 11.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.275 -0.875 . . . . 1.04 110.646 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.544 ' CG ' HD12 ' A' ' 48' ' ' LEU . 93.9 mt-30 -51.97 -43.08 63.4 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.715 -1.129 . . . . 1.96 112.397 177.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.568 ' HG2' ' O ' ' A' ' 102' ' ' MET . 24.7 mm-40 -70.63 -30.11 66.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.736 0.779 . . . . 3.11 109.897 -178.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.685 HG13 ' O ' ' A' ' 103' ' ' THR . 13.1 mt -75.98 -47.3 32.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 114.582 -1.19 . . . . 1.03 111.028 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.509 HD12 HD11 ' A' ' 48' ' ' LEU . 8.5 mt -58.46 -43.09 86.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.968 -0.56 . . . . 1.04 112.444 -176.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.622 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 16.5 t -67.53 -17.98 64.86 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.933 0.346 . . . . 1.67 111.933 -174.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -61.22 -31.95 71.73 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.499 -0.926 . . . . 1.99 108.499 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.457 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 15.4 m-85 -105.59 12.99 30.6 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.607 -1.179 . . . . 1.0 109.884 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.622 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 5.2 mmpt? -98.7 -38.6 9.04 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.631 -0.878 . . . . 1.46 108.631 171.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.69 -21.98 37.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.994 -1.003 . . . . 2.27 110.239 173.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -130.33 69.67 1.45 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.471 -0.786 . . . . 1.47 109.679 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 C--O 1.246 0.879 0 CA-C-N 115.563 -0.744 . . . . 2.72 111.063 -176.93 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.557 0 N-CA-C 111.874 -0.49 . . . . 20.26 111.874 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 19.8 p -75.67 124.89 88.97 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 120.586 0.231 . . . . 18.54 110.836 179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.73 46.02 1.92 Allowed 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.971 2.447 . . . . 17.79 112.734 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.48 1.32 60.84 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 116.022 -0.536 . . . . 16.44 113.246 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 60.23 93.73 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.284 0 CA-C-O 120.972 0.415 . . . . 16.12 110.982 -176.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -56.4 103.75 0.12 Allowed 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 123.228 2.619 . . . . 13.81 113.222 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -75.53 133.02 41.1 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.535 -0.543 . . . . 12.88 109.535 174.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 134.65 -32.46 2.61 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 110.739 -0.944 . . . . 9.73 110.739 -175.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . 0.409 HD22 ' C ' ' B' ' 527' ' ' LEU . 5.0 tt -131.21 80.73 1.95 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.055 -0.72 . . . . 8.74 109.055 174.57 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 39.3 tp -98.12 1.46 47.58 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 107.466 -1.309 . . . . 10.79 107.466 166.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 8.6 t -174.32 177.56 2.21 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 113.33 -1.759 . . . . 7.62 107.373 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 129.69 -61.94 0.65 Allowed Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.184 -1.007 . . . . 5.26 111.832 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -143.54 -33.55 0.43 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.855 0.836 . . . . 5.5 110.141 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . 0.688 ' HA ' ' OG ' ' B' ' 535' ' ' SER . 7.3 mt-10 -98.22 23.22 8.54 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 114.681 -1.145 . . . . 5.68 110.407 -177.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.34 -29.12 60.95 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.399 -1.273 . . . . 3.22 111.474 -177.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -114.75 -29.58 6.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.49 0.662 . . . . 5.14 110.26 175.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 535' ' ' SER . . . . . 0.688 ' OG ' ' HA ' ' B' ' 532' ' ' GLU . 2.4 p -82.46 -3.72 56.23 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.365 -0.834 . . . . 1.34 111.932 -174.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 61.2 p -77.17 -43.37 34.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.712 0.768 . . . . 2.43 109.161 171.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 49.5 mm -76.6 -35.31 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 115.064 -0.971 . . . . 1.69 109.58 177.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -78.01 -0.69 28.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.483 0.658 . . . . 1.36 110.442 175.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.44 ' HB2' ' O ' ' B' ' 535' ' ' SER . 35.3 t70 -85.22 -42.49 14.63 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.337 -0.986 . . . . 1.23 108.337 171.295 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 64.5 mmm -58.31 -32.13 68.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.424 -1.262 . . . . 2.83 109.785 171.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . 0.548 ' OD2' ' HE3' ' A' ' 57' ' ' LYS . 31.8 t70 -60.73 -41.65 95.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.926 -1.034 . . . . 1.18 110.812 174.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -76.67 -31.95 57.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.961 -0.563 . . . . 0.66 111.206 -176.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 17.4 m -52.66 -43.1 65.29 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 122.74 0.416 . . . . 2.08 112.065 -174.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -68.22 -32.71 73.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.007 0.432 . . . . 1.34 111.029 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . 0.726 ' O ' ' HG2' ' B' ' 548' ' ' GLN . 59.6 mt -78.83 -31.98 45.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.016 -0.538 . . . . 1.82 111.306 -176.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 14.1 mt -77.55 -22.51 50.94 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.4 0.619 . . . . 1.54 109.791 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 22.7 t -82.29 -51.8 7.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.928 -1.033 . . . . 1.92 109.986 174.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . 0.726 ' HG2' ' O ' ' B' ' 545' ' ' LEU . 54.5 mm-40 48.97 76.47 0.12 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.299 0.571 . . . . 3.31 111.811 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 35.0 pt -90.22 -13.1 9.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.764 -0.653 . . . . 5.68 110.272 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 31.2 t 72.98 -54.7 0.69 Allowed 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.941 0.776 . . . . 6.4 111.556 177.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 42.9 m . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.697 -0.668 . . . . 7.59 110.217 -179.952 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.518 ' HA ' ' OD1' ' A' ' 99' ' ' ASN . 2.1 Cg_endo . . . . . 0 N--CA 1.476 0.455 0 N-CA-C 110.639 -0.562 . . . . 2.47 110.639 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.8 t -136.19 151.23 49.5 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 120.972 0.415 . . . . 2.05 110.256 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.477 ' CD2' HG23 ' A' ' 103' ' ' THR . 27.2 m80 -109.59 6.02 23.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.658 -0.701 . . . . 1.08 110.261 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.1 t -156.03 155.76 33.22 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 119.981 -0.687 . . . . 1.78 112.411 -172.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.465 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -176.07 -163.84 29.32 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 110.523 -1.031 . . . . 0.16 110.523 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.9 130.08 46.05 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 117.308 0.554 . . . . 1.04 110.533 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.46 ' HB3' ' HB3' ' A' ' 89' ' ' PHE . . . -140.26 143.33 35.89 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.955 0.407 . . . . 1.02 111.548 -178.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.49 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 97.3 mt -106.89 109.24 27.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.076 -0.511 . . . . 1.17 110.124 176.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -110.19 137.97 47.2 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.533 -0.914 . . . . 0.43 108.533 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 53.59 25.84 5.21 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 122.705 0.402 . . . . 0.8 111.154 -176.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt 69.52 5.08 4.98 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.521 0.563 . . . . 2.57 112.521 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.411 HG13 ' HZ2' ' A' ' 36' ' ' LYS . 2.2 p -94.28 120.53 43.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 107.809 -1.182 . . . . 1.1 107.809 167.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.439 ' HA ' HG12 ' A' ' 8' ' ' ILE . 78.3 p -73.04 142.83 47.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.291 -0.413 . . . . 1.5 110.762 -175.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -163.07 -163.77 16.53 Favored Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.506 -0.854 . . . . 0.12 112.672 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.9 mm -123.41 133.85 67.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 109.293 -0.632 . . . . 1.02 109.293 -179.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.447 HD11 HD12 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.84 135.2 41.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 110.103 -0.332 . . . . 1.05 110.103 -176.257 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.45 129.99 29.81 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.693 0.282 . . . . 1.04 111.254 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.419 HD13 ' HB ' ' A' ' 103' ' ' THR . 47.6 mt -85.89 132.86 30.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.478 0.656 . . . . 1.04 110.439 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -102.82 104.92 15.23 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.748 -1.115 . . . . 1.98 111.064 -173.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -118.42 170.2 9.12 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.146 -0.687 . . . . 1.2 109.146 176.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.0 t70 79.26 -3.8 2.11 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 122.326 1.06 . . . . 0.58 109.557 -176.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.626 HG21 ' O ' ' A' ' 23' ' ' SER . 30.2 m -102.99 -173.1 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-N 113.832 -1.531 . . . . 1.05 109.427 178.207 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.626 ' O ' HG21 ' A' ' 22' ' ' VAL . 60.1 p -73.56 169.39 18.59 Favored Pre-proline 0 C--N 1.316 -0.858 0 N-CA-C 105.585 -2.006 . . . . 1.77 105.585 175.095 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.404 ' O ' HG12 ' A' ' 41' ' ' VAL . 74.5 Cg_exo -40.83 129.42 2.78 Favored 'Trans proline' 0 C--N 1.358 1.073 0 CA-C-N 121.486 1.566 . . . . 0.19 112.628 -143.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.465 ' H ' ' HH ' ' A' ' 111' ' ' TYR . . . -54.22 144.03 21.26 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 114.166 -1.379 . . . . 1.03 112.158 -162.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -125.25 168.83 12.94 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.497 -1.229 . . . . 0.32 111.864 -169.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.505 ' HB3' HG22 ' A' ' 40' ' ' VAL . 2.8 tm? -118.32 106.45 12.78 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 107.592 -1.262 . . . . 1.02 107.592 173.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.1 m -103.31 106.95 17.58 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 120.904 0.383 . . . . 1.02 111.027 -175.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.42 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 85.0 t90 -85.16 131.76 34.39 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.859 -0.793 . . . . 0.17 108.859 172.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.417 ' HG2' HG21 ' A' ' 37' ' ' VAL . 65.1 mtt180 -126.24 159.59 32.61 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.287 -0.634 . . . . 2.24 109.287 174.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.8 p -67.51 176.09 2.53 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.013 -0.736 . . . . 0.63 109.013 177.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.9 p -59.59 -41.75 90.98 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.659 -0.65 . . . . 0.96 111.013 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -82.82 -31.67 28.01 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.272 -0.64 . . . . 2.12 109.272 171.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.48 17.22 22.45 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.161 -0.927 . . . . 0.23 113.595 172.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -65.8 -52.04 54.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.203 0.501 . . . . 1.73 109.928 174.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.411 ' HZ2' HG13 ' A' ' 12' ' ' VAL . 40.8 tttt -77.01 135.93 38.69 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 109.058 -0.719 . . . . 1.91 109.058 176.297 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.42 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 13.8 p -150.03 135.39 10.75 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 CA-C-O 120.91 0.386 . . . . 1.04 111.137 -175.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -141.96 127.0 18.38 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.458 -0.571 . . . . 0.54 109.458 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.429 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 29.2 m -115.64 131.72 56.85 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.139 0.422 . . . . 1.04 112.139 -172.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.505 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -99.98 129.9 49.94 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 N-CA-C 107.851 -1.166 . . . . 1.04 107.851 168.422 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.43 ' O ' HG12 ' A' ' 45' ' ' ILE . 97.3 t -93.01 121.29 43.59 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 O-C-N 121.148 -0.97 . . . . 1.02 108.577 173.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -68.52 -17.11 64.09 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.564 0.579 . . . . 1.01 112.564 -170.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.53 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 97.7 p -68.5 -19.49 64.54 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.964 -0.754 . . . . 1.07 108.964 174.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.7 p -109.21 15.55 23.12 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.897 -1.047 . . . . 1.03 109.994 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.482 ' HA ' ' HA2' ' A' ' 64' ' ' GLY . 22.2 mm -114.62 141.38 31.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.402 -0.592 . . . . 1.01 109.402 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -102.01 -47.91 4.41 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.799 -0.637 . . . . 0.52 110.648 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 7.8 mtmm -141.86 169.56 17.35 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 120.599 0.238 . . . . 1.95 111.337 -177.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.638 ' CD2' HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -141.26 154.34 45.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.72 -0.845 . . . . 1.39 108.72 175.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.496 ' HG3' HD13 ' A' ' 63' ' ' ILE . 23.5 mt-30 -135.74 145.55 46.74 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 109.365 -0.606 . . . . 2.02 109.365 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.416 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -137.92 134.74 35.34 Favored 'General case' 0 C--N 1.319 -0.746 0 O-C-N 121.726 -0.609 . . . . 1.05 110.672 175.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.536 HG23 ' HB3' ' A' ' 57' ' ' LYS . 68.8 p -59.99 119.08 38.4 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.801 -0.636 . . . . 1.05 110.704 -177.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.499 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 17.4 Cg_exo -57.21 162.19 9.97 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.664 2.242 . . . . 0.44 111.948 177.032 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.8 -19.6 64.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.084 -0.507 . . . . 1.21 110.899 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 45.7 t -82.59 -18.15 42.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.921 -0.581 . . . . 1.94 110.594 176.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.499 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 48.1 m -76.09 137.8 40.37 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.261 -0.427 . . . . 1.13 111.057 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.54 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 39.8 mt-10 -52.38 -35.38 51.42 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 122.038 0.923 . . . . 1.77 109.987 173.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.54 ' HD2' ' HB2' ' A' ' 56' ' ' GLU . 10.6 mptt -82.09 158.06 23.86 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.112 -1.404 . . . . 2.18 112.984 -169.861 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.423 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.3 OUTLIER -130.68 96.65 4.15 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.585 -1.189 . . . . 1.11 108.485 169.295 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.512 ' HE1' ' HG2' ' A' ' 57' ' ' LYS . 0.2 OUTLIER -155.16 154.43 32.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.237 0.541 . . . . 1.05 111.55 -173.799 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.449 HD11 ' O ' ' A' ' 97' ' ' MET . 1.6 tt -131.0 120.68 23.84 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.452 -0.944 . . . . 1.05 108.452 177.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.574 ' HG3' ' CE2' ' B' ' 542' ' ' PHE . 14.1 mtp180 -104.6 145.11 30.78 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.036 0.446 . . . . 3.5 111.743 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.638 HD13 ' CD2' ' A' ' 48' ' ' LEU . 1.2 mm? -122.43 106.69 11.27 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.31 -0.859 . . . . 1.03 109.587 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.626 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.9 mp -85.19 99.39 7.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 C-N-CA 122.484 0.314 . . . . 1.11 110.211 -174.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.482 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -72.57 145.13 36.65 Favored Glycine 0 C--O 1.221 -0.689 0 C-N-CA 120.971 -0.633 . . . . 0.54 112.587 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.411 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 89.2 mttt -66.2 146.29 54.8 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 122.692 0.397 . . . . 1.08 111.16 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.522 ' CG1' ' HA ' ' A' ' 84' ' ' PRO . 6.5 m -120.1 150.99 22.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.308 -0.557 . . . . 2.32 111.332 169.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.716 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 26.3 t70 -83.16 83.63 7.78 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.469 -0.937 . . . . 3.23 108.469 172.072 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -64.84 -4.68 4.69 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.702 0.63 . . . . 2.39 112.702 -169.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.6 p -77.49 -4.04 43.52 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.08 0.467 . . . . 3.2 110.524 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.716 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -85.2 30.39 0.6 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.907 -0.588 . . . . 2.95 110.669 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.426 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 20.0 mtmt -46.82 114.81 0.9 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.262 0.553 . . . . 3.72 110.269 -174.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 55.6 ttt180 -89.11 168.62 12.18 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.611 -0.885 . . . . 4.12 108.611 -169.825 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.625 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 58.1 mttp -131.13 140.08 49.92 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 118.298 0.499 . . . . 4.59 110.625 174.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.448 ' CG ' ' H ' ' A' ' 75' ' ' ASN . 9.1 t70 -83.61 -173.07 4.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.763 -0.653 . . . . 4.41 110.323 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.448 ' H ' ' CG ' ' A' ' 74' ' ' ASP . 29.7 m-80 -59.56 -31.63 69.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.212 0.53 . . . . 5.69 110.853 -177.07 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -87.35 1.43 53.34 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.969 -0.56 . . . . 5.38 110.789 -177.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.26 7.74 84.59 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.753 -0.737 . . . . 4.47 111.681 -175.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.625 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 51.1 m-20 -57.4 128.32 36.45 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 110.186 -0.301 . . . . 4.72 110.186 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -73.59 90.12 1.76 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.676 -0.491 . . . . 4.28 109.676 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.429 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 11.1 m -103.24 98.47 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-O 122.026 0.917 . . . . 3.51 109.618 -178.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.463 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.2 p -88.1 119.78 70.47 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-N 115.57 -0.741 . . . . 2.87 109.736 -178.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 31.4 Cg_exo -63.16 134.52 46.13 Favored 'Trans proline' 0 CA--C 1.51 -0.712 0 C-N-CA 122.881 2.387 . . . . 2.06 112.588 -173.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.473 ' HE3' ' O ' ' B' ' 523' ' ' TYR . 12.7 ptmm? -79.96 159.87 70.01 Favored Pre-proline 0 C--N 1.315 -0.917 0 CA-C-N 115.117 -0.947 . . . . 3.13 108.558 174.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.522 ' HA ' ' CG1' ' A' ' 66' ' ' VAL . 32.0 Cg_exo -57.24 152.75 43.73 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.327 2.018 . . . . 0.99 111.851 -177.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -64.59 164.21 12.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.494 -0.775 . . . . 2.11 109.516 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.566 ' HG2' ' CZ ' ' A' ' 61' ' ' ARG . 44.0 ttt180 -155.74 110.51 2.92 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 122.289 1.043 . . . . 3.17 109.973 -178.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 78.0 m-70 -95.71 152.2 18.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.738 -1.574 . . . . 0.72 107.695 -176.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.565 ' HB2' ' HG2' ' A' ' 61' ' ' ARG . 26.3 ttm -141.87 129.52 21.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 119.183 0.901 . . . . 1.07 111.77 174.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.46 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 4.7 m-85 -118.4 129.38 55.38 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.361 -0.836 . . . . 0.27 109.527 178.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.49 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.03 153.13 27.57 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 121.996 -0.44 . . . . 1.68 110.526 177.217 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.41 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.0 m-85 -133.59 172.53 12.62 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 0.32 111.133 -175.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -119.26 -11.58 9.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.567 -0.742 . . . . 2.7 109.804 177.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.435 ' HB2' HG22 ' A' ' 96' ' ' VAL . 41.5 m-80 -142.66 131.01 22.2 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.212 0.53 . . . . 1.16 110.633 -177.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.459 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.5 mmm180 -64.62 -34.2 77.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.196 -0.911 . . . . 3.7 111.938 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.2 m -62.75 -36.23 82.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.883 0.373 . . . . 1.13 110.824 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.553 ' O ' HG12 ' A' ' 100' ' ' ILE . 10.5 t -67.71 -56.11 14.41 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.399 0 CA-C-N 116.074 -0.512 . . . . 1.06 110.306 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.459 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.8 ptp -58.45 -37.83 76.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.088 -0.505 . . . . 1.02 111.041 -177.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -70.09 -26.25 63.89 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.973 -0.291 . . . . 0.34 111.085 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.518 ' OD1' ' HA ' ' A' ' 1' ' ' PRO . 5.5 m-80 -85.93 -39.65 16.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.312 -0.403 . . . . 1.58 111.034 178.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.553 HG12 ' O ' ' A' ' 96' ' ' VAL . 29.0 mm -64.98 -56.44 15.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 108.729 -0.841 . . . . 1.01 108.729 176.362 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.416 ' HD3' ' HB2' ' A' ' 50' ' ' ALA . 31.0 ttpt -48.31 -47.75 36.41 Favored 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 123.894 0.746 . . . . 1.47 110.161 175.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.711 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 36.2 ttp -50.89 -60.44 3.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.186 -0.915 . . . . 1.02 111.084 178.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.744 ' O ' HG13 ' A' ' 107' ' ' ILE . 86.6 m -55.95 -53.84 52.03 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 123.49 0.494 . . . . 1.04 110.75 -178.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.59 HD11 HD23 ' A' ' 62' ' ' LEU . 25.8 mt -46.54 -58.03 4.17 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.694 0.621 . . . . 1.04 110.261 176.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.469 ' HG3' ' CD1' ' A' ' 48' ' ' LEU . 70.4 mt-30 -52.69 -44.56 66.36 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.303 -0.862 . . . . 1.96 112.511 175.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.711 ' HG3' ' O ' ' A' ' 102' ' ' MET . 48.3 mt-30 -62.07 -30.65 71.13 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.709 0.766 . . . . 3.11 109.659 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.744 HG13 ' O ' ' A' ' 103' ' ' THR . 6.4 mt -81.75 -41.1 18.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 114.688 -1.142 . . . . 1.03 111.297 -177.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.517 HG13 ' O ' ' A' ' 104' ' ' LEU . 5.2 mt -60.27 -42.2 89.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 112.948 0.721 . . . . 1.04 112.948 -174.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.648 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 2.1 p -65.81 -16.35 63.72 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.573 -0.451 . . . . 1.67 112.159 -175.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -63.06 -28.27 69.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.637 0.732 . . . . 1.99 109.096 169.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.53 ' CG ' ' HA ' ' A' ' 43' ' ' SER . 29.0 m-85 -110.41 10.83 23.32 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.95 -1.023 . . . . 1.0 110.309 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.648 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 9.2 mmpt? -94.44 -38.25 11.03 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.648 -0.871 . . . . 1.46 108.648 171.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.95 -24.65 26.46 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.848 -1.069 . . . . 2.27 110.619 176.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -124.89 66.2 1.11 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.131 -0.486 . . . . 1.47 111.171 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.454 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 35.7 t70 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.557 -0.735 . . . . 2.72 110.108 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.728 0 N-CA-C 111.783 -0.527 . . . . 20.26 111.783 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 20.7 m 60.44 70.7 0.95 Allowed Pre-proline 0 CA--C 1.53 0.208 0 CA-C-O 121.008 0.432 . . . . 18.54 111.059 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo -80.66 33.56 0.52 Allowed 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.977 2.452 . . . . 17.79 112.97 -177.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -69.18 -44.68 65.08 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 111.336 -0.706 . . . . 16.44 111.336 176.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . 0.473 ' O ' ' HE3' ' A' ' 83' ' ' LYS . 76.4 m-85 -121.56 91.04 48.35 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.298 -0.63 . . . . 16.12 109.298 174.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -71.31 -60.45 0.06 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.494 2.129 . . . . 13.81 112.119 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -168.89 178.0 4.74 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.778 -0.823 . . . . 12.88 108.778 -178.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -177.62 -129.33 1.25 Allowed Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.41 -0.676 . . . . 9.73 111.41 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . 0.528 ' H ' HD12 ' B' ' 527' ' ' LEU . 0.0 OUTLIER -79.94 46.23 0.78 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.359 0.6 . . . . 8.74 110.99 177.818 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . 0.429 HD23 ' N ' ' A' ' 86' ' ' ARG . 7.1 tt -81.03 86.36 6.14 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.737 -0.665 . . . . 10.79 110.411 -173.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 23.9 m 59.36 16.49 5.12 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.37 -0.832 . . . . 7.62 112.822 172.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 71.07 40.08 62.38 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.884 -0.674 . . . . 5.26 112.416 -177.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -113.94 49.11 1.02 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.85 -1.167 . . . . 5.5 107.85 177.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -99.84 -6.93 26.02 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.272 -1.331 . . . . 5.68 113.185 -164.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -97.68 -62.16 1.29 Allowed 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 113.026 0.75 . . . . 3.22 113.026 -170.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 21.6 p90 -115.11 -35.01 4.84 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.373 0.606 . . . . 5.14 110.87 -178.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 1.4 p -76.62 -3.35 37.28 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.412 -0.813 . . . . 1.34 110.132 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 536' ' ' SER . . . . . 0.517 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 22.7 p -74.64 -43.95 52.88 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.579 -0.737 . . . . 2.43 109.735 171.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 35.9 mm -75.09 -37.22 40.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.536 -0.756 . . . . 1.69 109.953 176.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . 0.404 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -76.47 1.57 16.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.854 0.835 . . . . 1.36 110.591 177.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.517 ' HB3' ' O ' ' B' ' 536' ' ' SER . 6.6 t70 -88.07 -53.08 4.9 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.687 -1.142 . . . . 1.23 109.079 173.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 42.3 ttp -55.97 -36.71 68.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.767 -1.106 . . . . 2.83 109.621 173.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . 0.52 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 2.0 t70 -55.17 -50.87 68.24 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.385 -1.28 . . . . 1.18 111.018 177.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.574 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.3 OUTLIER -64.12 -37.43 87.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.095 0.474 . . . . 0.66 111.013 -173.511 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 12.6 m -64.36 -21.72 66.72 Favored 'General case' 0 N--CA 1.435 -1.209 0 CA-C-N 115.885 -0.598 . . . . 2.08 110.957 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -91.82 -23.51 19.66 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.027 -0.533 . . . . 1.34 110.78 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 96.5 mt -75.86 -29.87 58.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.31 -0.404 . . . . 1.82 111.648 -178.214 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . 0.482 HD12 ' HB3' ' A' ' 49' ' ' GLN . 56.7 mt -89.02 -5.91 57.57 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.712 0.768 . . . . 1.54 109.009 173.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 28.7 t -115.78 41.26 2.58 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.448 -1.251 . . . . 1.92 110.311 178.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -85.23 21.98 1.58 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.824 0.345 . . . . 3.31 110.211 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 13.6 mt 62.61 21.98 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-O 121.821 0.82 . . . . 5.68 110.074 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 23.5 m -137.88 43.09 2.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.692 -0.685 . . . . 6.4 110.631 -175.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.675 -0.678 . . . . 7.59 109.935 178.045 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.527 ' HA ' ' OD1' ' A' ' 99' ' ' ASN . 3.0 Cg_exo . . . . . 0 N--CA 1.478 0.57 0 N-CA-C 110.45 -0.635 . . . . 2.47 110.45 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 p -86.9 143.19 27.53 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 121.215 0.531 . . . . 2.05 110.809 -177.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.404 ' CD2' HG23 ' A' ' 103' ' ' THR . 50.8 m80 -99.44 8.05 44.91 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.693 -0.685 . . . . 1.08 110.341 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 43.3 t -157.05 157.6 34.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.544 0.687 . . . . 1.78 112.409 -172.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.52 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.39 -167.16 37.0 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 109.813 -1.315 . . . . 0.16 109.813 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -93.73 135.62 34.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 118.008 0.904 . . . . 1.04 110.583 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.495 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -146.78 142.14 27.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.074 -0.512 . . . . 1.02 111.376 -177.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.763 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.0 mt -98.95 128.25 50.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 110.193 -0.299 . . . . 1.17 110.193 174.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.488 ' HE2' ' ND1' ' A' ' 38' ' ' HIS . 10.7 t80 -135.19 140.48 45.36 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.756 -0.831 . . . . 0.43 108.756 175.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 60.63 24.27 14.04 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.451 0.469 . . . . 0.8 109.87 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt 69.49 -2.75 1.81 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.018 0.927 . . . . 2.57 113.109 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -92.31 123.68 44.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 108.766 -0.828 . . . . 1.1 108.766 170.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.3 m -74.86 145.38 42.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.325 -0.398 . . . . 1.5 110.362 -176.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.01 -158.53 10.15 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 119.869 -1.158 . . . . 0.12 113.497 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.4 mm -125.3 131.5 72.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.456 -0.572 . . . . 1.02 109.456 -177.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.431 HD13 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -101.55 136.15 34.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 110.005 -0.369 . . . . 1.05 110.005 -177.297 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.49 131.31 31.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.608 0.242 . . . . 1.04 111.39 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 54.7 mt -86.21 138.41 19.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 121.211 0.529 . . . . 1.04 110.403 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -109.83 105.23 14.36 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.928 -1.033 . . . . 1.98 111.246 -175.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.422 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 36.5 mt-10 -116.99 170.35 8.7 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.902 -0.777 . . . . 1.2 108.902 175.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.422 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 36.3 t70 78.58 -5.01 2.09 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.38 1.086 . . . . 0.58 109.777 -177.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.636 HG22 ' O ' ' A' ' 23' ' ' SER . 31.1 m -102.62 -173.33 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 CA-C-N 113.872 -1.513 . . . . 1.05 109.824 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.636 ' O ' HG22 ' A' ' 22' ' ' VAL . 48.2 m -72.78 167.33 34.56 Favored Pre-proline 0 C--N 1.315 -0.914 0 N-CA-C 105.322 -2.103 . . . . 1.77 105.322 174.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -41.49 127.62 3.28 Favored 'Trans proline' 0 C--N 1.352 0.736 0 CA-C-N 121.13 1.439 . . . . 0.19 112.534 -142.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.428 ' HB1' ' CG2' ' A' ' 107' ' ' ILE . . . -49.64 140.25 11.41 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 113.919 -1.491 . . . . 1.03 112.434 -165.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -125.43 169.48 12.34 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 114.09 -1.414 . . . . 0.32 111.585 -168.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.508 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.1 tm? -118.89 105.64 11.7 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 107.612 -1.255 . . . . 1.02 107.612 173.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 m -100.67 106.48 17.94 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-O 120.973 0.416 . . . . 1.02 110.743 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.3 t90 -85.01 132.02 34.39 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.91 -0.774 . . . . 0.17 108.91 171.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.476 ' HG2' HG23 ' A' ' 37' ' ' VAL . 93.6 mtt180 -126.0 159.74 31.89 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.258 -0.645 . . . . 2.24 109.258 174.015 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 p -70.71 177.68 3.44 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 110.077 -0.342 . . . . 0.63 110.077 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 p -64.79 -23.19 67.16 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.398 -0.521 . . . . 0.96 111.479 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -99.4 -31.63 11.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.644 0.735 . . . . 2.12 109.054 169.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.418 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 98.49 16.59 31.39 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 114.712 -1.131 . . . . 0.23 112.153 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -67.19 -39.63 86.4 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.263 -0.643 . . . . 1.73 109.263 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.8 tttm -93.68 141.21 28.74 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.412 -0.959 . . . . 1.91 108.412 175.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.476 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.1 p -147.31 136.89 16.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 120.963 0.411 . . . . 1.04 111.007 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.488 ' ND1' ' HE2' ' A' ' 9' ' ' PHE . 3.3 t60 -143.67 118.07 9.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.275 -0.421 . . . . 0.54 109.941 -178.102 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 24.7 m -110.79 133.79 53.05 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.409 0.522 . . . . 1.04 112.409 -173.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.508 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.63 130.24 54.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 N-CA-C 108.103 -1.073 . . . . 1.04 108.103 168.543 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 90.4 t -93.34 120.4 42.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 O-C-N 121.202 -0.936 . . . . 1.02 108.754 173.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -68.14 -19.4 64.81 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.231 0.826 . . . . 1.01 113.231 -169.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.565 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 9.8 p -70.2 -13.45 62.19 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.336 0.589 . . . . 1.07 109.641 175.503 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.4 p -108.66 11.28 26.63 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.477 -0.783 . . . . 1.03 109.583 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.457 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 26.3 mm -113.83 144.68 20.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.102 -0.703 . . . . 1.01 109.102 178.593 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -110.77 -41.79 4.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.78 0.324 . . . . 0.52 110.968 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.511 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 14.9 mtmt -140.33 174.39 10.56 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.106 0.479 . . . . 1.95 111.029 -179.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.543 HD13 ' CG ' ' A' ' 105' ' ' GLN . 0.1 OUTLIER -152.49 134.73 15.04 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.673 -0.862 . . . . 1.39 108.673 -178.106 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -133.45 115.19 14.5 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 122.268 -0.27 . . . . 2.02 111.289 -170.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.42 ' C ' ' HZ ' ' B' ' 542' ' ' PHE . . . -114.8 146.67 40.77 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.179 -0.326 . . . . 1.05 111.802 -175.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.488 ' N ' ' HZ ' ' B' ' 542' ' ' PHE . 80.5 p -72.44 120.91 83.15 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 115.922 -0.581 . . . . 1.05 110.921 -176.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.618 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 10.0 Cg_exo -62.3 165.96 13.98 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.832 2.355 . . . . 0.44 111.921 175.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.89 -27.25 67.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.042 -0.526 . . . . 1.21 111.313 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.5 m -84.91 -4.84 59.28 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.87 -0.605 . . . . 1.94 110.772 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.618 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 35.2 m -82.64 148.53 27.91 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.03 -0.532 . . . . 1.13 111.635 178.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -70.52 7.04 1.17 Allowed 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.169 -0.923 . . . . 1.77 111.909 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.497 ' H ' ' C ' ' A' ' 55' ' ' SER . 40.7 mmtm -130.26 153.3 48.76 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 115.171 -0.922 . . . . 2.18 111.204 -167.265 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.487 ' O ' ' HG3' ' A' ' 59' ' ' MET . 80.1 mmm -125.61 97.23 5.08 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.565 -0.902 . . . . 1.11 108.565 167.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.487 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.1 OUTLIER -155.28 156.32 35.33 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.242 0.544 . . . . 1.05 111.983 -172.538 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.523 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.3 tt -135.17 118.88 17.11 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.435 -0.95 . . . . 1.05 108.435 177.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.718 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.2 mtp180 -101.85 144.6 30.3 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.342 0.591 . . . . 3.5 111.748 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.532 HD23 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -120.24 110.19 16.29 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.776 -1.102 . . . . 1.03 108.863 178.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.518 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.4 mp -88.88 100.91 11.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.135 0.493 . . . . 1.11 110.475 -172.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.637 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -71.22 141.02 31.91 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.652 -0.704 . . . . 0.54 112.615 -177.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.457 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 79.7 mttt -60.98 123.76 18.54 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.992 0.738 . . . . 1.08 112.992 -174.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.695 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 2.0 t -120.3 139.76 46.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 114.933 -1.03 . . . . 2.32 109.744 171.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 5.3 m-20 -80.13 86.9 5.51 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 108.687 -0.856 . . . . 3.23 108.687 174.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.436 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 43.1 mt-10 -65.02 -2.58 2.8 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.606 0.241 . . . . 2.39 111.618 -175.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.461 ' C ' ' H ' ' A' ' 71' ' ' LYS . 12.9 p -69.6 -13.26 62.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.388 0.613 . . . . 3.2 109.761 169.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.541 ' NZ ' ' HG2' ' A' ' 82' ' ' PRO . 13.6 ptmm? -75.34 29.69 0.1 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.164 -0.926 . . . . 2.95 110.797 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.461 ' H ' ' C ' ' A' ' 69' ' ' SER . 20.0 mtmt -48.09 114.66 0.97 Allowed 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.369 0.604 . . . . 3.72 109.835 -174.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.521 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 79.3 ttt180 -92.91 165.65 12.78 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 114.976 -1.011 . . . . 4.12 108.838 -171.333 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.421 ' HD3' ' O ' ' A' ' 77' ' ' GLY . 54.9 mttp -127.11 139.34 53.05 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.302 0.572 . . . . 4.59 109.919 171.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.467 ' CG ' ' H ' ' A' ' 75' ' ' ASN . 13.7 t70 -91.79 -165.33 1.33 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.175 -0.92 . . . . 4.41 110.368 -174.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.467 ' H ' ' CG ' ' A' ' 74' ' ' ASP . 78.9 m-20 -62.71 -33.17 74.56 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.375 0.509 . . . . 5.69 112.375 -169.11 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -84.28 1.62 43.97 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 111.67 0.248 . . . . 5.38 111.67 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.421 ' O ' ' HD3' ' A' ' 73' ' ' LYS . . . 79.72 4.33 89.34 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.55 -0.833 . . . . 4.47 111.422 -175.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -72.01 140.49 49.09 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.921 -0.4 . . . . 4.72 109.921 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -68.98 116.87 9.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.105 -0.498 . . . . 4.28 110.879 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.521 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 9.8 m -122.47 98.85 6.13 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 108.877 -0.786 . . . . 3.51 108.877 173.021 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 1.2 p -86.31 109.94 27.34 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-O 121.235 0.541 . . . . 2.87 110.126 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.541 ' HG2' ' NZ ' ' A' ' 70' ' ' LYS . 52.5 Cg_exo -60.91 138.89 81.9 Favored 'Trans proline' 0 CA--C 1.513 -0.547 0 C-N-CA 123.549 2.833 . . . . 2.06 112.279 -177.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 ptmm? -94.27 155.26 40.06 Favored Pre-proline 0 N--CA 1.442 -0.841 0 CA-C-N 115.167 -0.924 . . . . 3.13 110.251 -175.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.695 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 72.8 Cg_exo -48.06 153.32 2.82 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.576 2.851 . . . . 0.99 113.461 177.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -86.9 115.4 24.28 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 115.21 -0.904 . . . . 2.11 109.679 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.496 ' HG2' HG13 ' A' ' 63' ' ' ILE . 85.9 mtt180 -100.44 130.37 46.52 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-N 114.97 -1.014 . . . . 3.17 111.307 -171.451 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.522 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 67.1 m-70 -95.87 145.88 25.02 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 106.954 -1.499 . . . . 0.72 106.954 176.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.718 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 15.6 ttm -140.09 125.98 19.54 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 119.403 1.001 . . . . 1.07 111.814 175.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.472 ' O ' ' HA ' ' A' ' 59' ' ' MET . 15.8 m-85 -108.12 158.07 17.74 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.965 -1.016 . . . . 0.27 108.72 176.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.763 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -106.69 157.6 17.59 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 108.806 -0.812 . . . . 1.68 108.806 175.455 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.523 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 30.9 m-85 -139.39 170.46 15.88 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.011 0.434 . . . . 0.32 111.615 -176.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -123.86 -5.78 7.98 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.593 -0.731 . . . . 2.7 110.379 176.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.6 m-80 -147.13 126.15 12.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.041 -0.527 . . . . 1.16 109.918 179.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.599 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 13.8 mmm180 -61.52 -35.4 77.62 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 116.011 -0.541 . . . . 3.7 110.994 177.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -56.85 -36.2 69.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.186 -0.461 . . . . 1.13 110.423 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.619 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.6 t -69.18 -60.26 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.022 -0.536 . . . . 1.06 110.329 176.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.599 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.5 ptp -57.93 -40.14 79.71 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 116.578 -0.283 . . . . 1.02 110.813 -176.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.477 ' N ' ' HG3' ' A' ' 97' ' ' MET . 35.2 t70 -58.92 -44.44 91.31 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.477 -0.489 . . . . 0.34 110.381 176.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.527 ' OD1' ' HA ' ' A' ' 1' ' ' PRO . 5.9 m-80 -72.24 -42.4 65.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.303 -0.408 . . . . 1.58 111.927 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.619 HG12 ' O ' ' A' ' 96' ' ' VAL . 27.3 mm -61.94 -56.94 14.49 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 N-CA-C 108.833 -0.802 . . . . 1.01 108.833 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.42 ' HE3' ' NE2' ' A' ' 105' ' ' GLN . 31.7 ttpt -49.43 -52.69 27.22 Favored 'General case' 0 C--O 1.216 -0.683 0 O-C-N 123.934 0.771 . . . . 1.47 109.762 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.551 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 39.1 ttp -48.17 -53.28 17.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.121 -0.945 . . . . 1.02 111.474 178.688 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.722 ' O ' HG13 ' A' ' 107' ' ' ILE . 85.6 m -60.64 -54.51 44.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.134 -0.484 . . . . 1.04 110.483 178.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.54 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 24.9 mt -47.9 -54.54 12.33 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.782 0.676 . . . . 1.04 110.63 177.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.543 ' CG ' HD13 ' A' ' 48' ' ' LEU . 94.1 mt-30 -49.02 -49.0 43.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.391 -1.277 . . . . 1.96 111.923 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.551 ' HG2' ' O ' ' A' ' 102' ' ' MET . 27.6 mm-40 -67.77 -28.38 67.56 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.451 0.643 . . . . 3.11 110.556 -177.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.722 HG13 ' O ' ' A' ' 103' ' ' THR . 8.2 mt -75.87 -41.18 39.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-N 115.128 -0.942 . . . . 1.03 110.642 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 104' ' ' LEU . 7.5 mt -65.16 -40.58 89.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.387 -0.369 . . . . 1.04 111.614 -178.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.2 p -61.02 -18.91 60.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.838 0.351 . . . . 1.67 111.517 -177.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -66.58 -48.71 68.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.311 0.577 . . . . 1.99 109.443 173.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.565 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 15.4 m-85 -77.48 -22.68 50.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.316 -0.857 . . . . 1.0 109.859 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -21.43 65.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.019 -0.991 . . . . 1.46 109.911 177.182 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -99.59 -37.71 9.04 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.823 -0.626 . . . . 2.27 110.042 175.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -87.0 29.84 0.8 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.3 -0.864 . . . . 1.47 112.223 -172.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 30.4 t70 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.611 -0.709 . . . . 2.72 109.929 177.108 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 112.0 -0.44 . . . . 20.26 112.0 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 22.2 t -129.47 80.02 72.79 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-O 120.995 0.426 . . . . 18.54 110.867 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -87.32 176.26 4.34 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.806 2.337 . . . . 17.79 111.47 175.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -86.22 0.3 87.24 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.893 -0.67 . . . . 16.44 111.719 177.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 57.61 72.77 0.85 Allowed Pre-proline 0 C--N 1.331 -0.219 0 C-N-CA 123.265 0.626 . . . . 16.12 111.53 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.83 -39.13 11.97 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.312 2.008 . . . . 13.81 111.398 175.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -105.57 -45.81 4.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.936 -0.575 . . . . 12.88 109.858 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 144.01 -144.47 13.54 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.765 -0.731 . . . . 9.73 112.466 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 7.9 tt -134.45 96.72 3.64 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.634 -0.506 . . . . 8.74 109.634 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 45.8 tp -113.49 9.59 18.07 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.882 -0.784 . . . . 10.79 108.882 174.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 7.9 p -166.23 56.56 0.1 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.195 -0.911 . . . . 7.62 110.658 -176.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -124.51 -97.26 1.18 Allowed Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.61 -0.805 . . . . 5.26 112.076 -177.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -127.36 14.43 7.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.035 0.445 . . . . 5.5 110.426 -178.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . 0.477 ' HA ' ' OG ' ' B' ' 535' ' ' SER . 4.8 mm-40 -105.66 15.85 26.26 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.748 0.785 . . . . 5.68 111.158 -177.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -76.92 -57.94 3.56 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.768 -1.106 . . . . 3.22 111.061 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -66.77 -24.61 66.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.417 0.627 . . . . 5.14 110.685 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 535' ' ' SER . . . . . 0.477 ' OG ' ' HA ' ' B' ' 532' ' ' GLU . 3.9 p -81.48 -4.05 54.78 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.561 -0.745 . . . . 1.34 110.619 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 22.9 t -77.64 -25.54 49.75 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.031 -0.729 . . . . 2.43 109.031 171.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 40.9 mm -84.83 -31.22 7.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 109.282 -0.636 . . . . 1.69 109.282 171.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -75.95 2.49 12.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.778 0.799 . . . . 1.36 110.103 172.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -82.35 -41.55 19.88 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.923 -1.035 . . . . 1.23 108.333 170.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 81.4 mmm -60.26 -33.82 72.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.434 -1.257 . . . . 2.83 109.624 172.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -57.23 -57.16 13.8 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.436 -0.802 . . . . 1.18 109.966 174.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.488 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -60.42 -40.95 92.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.116 -0.947 . . . . 0.66 111.558 -176.048 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 36.6 m -61.27 -37.27 82.52 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.903 -0.59 . . . . 2.08 111.441 -178.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -78.88 -28.15 44.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.215 0.531 . . . . 1.34 110.215 176.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . 0.417 HD23 ' HB3' ' A' ' 55' ' ' SER . 58.4 tp -71.57 -49.59 39.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.138 -0.937 . . . . 1.82 111.643 -177.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 8.5 mt -70.06 -25.51 63.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.365 0.602 . . . . 1.54 109.791 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 18.3 t -70.73 -15.28 62.68 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.073 -0.967 . . . . 1.92 110.503 177.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 16.2 mm100 -68.13 -37.08 80.69 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.517 0.675 . . . . 3.31 110.537 177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 51.3 mt -92.51 -43.02 13.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 CA-C-N 114.798 -1.092 . . . . 5.68 110.193 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 22.2 t -82.19 82.52 7.69 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.783 -0.644 . . . . 6.4 110.303 -179.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.339 -0.839 . . . . 7.59 110.081 176.684 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo . . . . . 0 N--CA 1.474 0.366 0 N-CA-C 110.645 -0.56 . . . . 2.47 110.645 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.2 m -72.81 116.83 13.78 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.418 0.627 . . . . 2.05 110.716 -176.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.487 ' CD2' HG21 ' A' ' 103' ' ' THR . 41.7 m80 -92.21 11.57 25.22 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.387 -0.824 . . . . 1.08 109.704 176.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.8 p -158.29 164.68 36.18 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 119.749 -0.78 . . . . 1.78 112.648 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.423 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 176.76 -163.75 32.91 Favored Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 114.692 -1.14 . . . . 0.16 110.916 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.83 135.72 43.97 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.677 -0.49 . . . . 1.04 109.677 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.471 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -148.54 143.01 26.36 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.039 0.447 . . . . 1.02 111.756 -175.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.455 HG12 ' HA ' ' A' ' 13' ' ' SER . 89.1 mt -106.63 124.21 62.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.22 -0.446 . . . . 1.17 110.226 177.102 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -127.35 140.75 51.98 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 108.682 -0.858 . . . . 0.43 108.682 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 54.36 25.62 6.16 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.636 0.375 . . . . 0.8 111.113 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm 65.49 14.44 9.47 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.801 0.667 . . . . 2.57 112.801 -177.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.435 HG11 ' CH2' ' A' ' 29' ' ' TRP . 2.1 p -103.97 121.72 55.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 108.428 -0.953 . . . . 1.1 108.428 166.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.455 ' HA ' HG12 ' A' ' 8' ' ' ILE . 50.1 p -75.49 144.38 42.05 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.379 -0.373 . . . . 1.5 110.85 -175.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.421 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.96 -160.01 10.64 Favored Glycine 0 N--CA 1.437 -1.243 0 C-N-CA 120.256 -0.973 . . . . 0.12 113.527 -177.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.7 mm -126.12 132.19 70.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 109.296 -0.631 . . . . 1.02 109.296 -177.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.441 HD11 HD12 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.37 136.39 34.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 120.684 0.278 . . . . 1.05 110.477 -175.664 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.24 127.26 25.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.92 0.391 . . . . 1.04 111.76 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.475 HD12 ' HA ' ' A' ' 3' ' ' HIS . 57.8 mt -86.11 135.51 24.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.757 -0.461 . . . . 1.04 109.757 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -110.32 106.72 16.2 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.164 -0.471 . . . . 1.98 110.989 -175.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.425 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 30.4 mt-10 -117.35 170.25 8.86 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.848 -0.797 . . . . 1.2 108.848 174.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.425 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 34.6 t70 78.04 -3.98 2.28 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 122.342 1.068 . . . . 0.58 109.737 -176.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 23' ' ' SER . 32.9 m -103.09 -174.07 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-N 113.96 -1.473 . . . . 1.05 109.651 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.589 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.8 m -72.35 164.66 57.78 Favored Pre-proline 0 C--N 1.316 -0.868 0 N-CA-C 104.997 -2.223 . . . . 1.77 104.997 174.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 82.2 Cg_exo -41.45 128.79 3.46 Favored 'Trans proline' 0 C--N 1.353 0.785 0 CA-C-N 120.949 1.374 . . . . 0.19 112.744 -141.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.41 ' HB2' HG23 ' A' ' 107' ' ' ILE . . . -47.66 141.3 5.46 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 113.919 -1.491 . . . . 1.03 112.703 -165.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -127.71 164.7 21.54 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 114.382 -1.281 . . . . 0.32 111.731 -169.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.49 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.2 tm? -115.48 105.44 12.81 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 107.55 -1.278 . . . . 1.02 107.55 173.708 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.0 m -100.39 106.71 18.33 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 120.941 0.4 . . . . 1.02 110.57 -176.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.435 ' CH2' HG11 ' A' ' 12' ' ' VAL . 82.7 t90 -84.67 131.72 34.55 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.801 -0.815 . . . . 0.17 108.801 172.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.506 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 36.8 mtm180 -122.66 160.86 24.93 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.824 -0.806 . . . . 2.24 108.824 175.455 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -72.38 178.1 4.18 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.995 -0.743 . . . . 0.63 108.995 175.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.421 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 5.1 p -60.43 -31.25 70.23 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.307 -0.557 . . . . 0.96 111.046 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -94.6 -24.27 17.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.785 0.802 . . . . 2.12 109.686 172.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.506 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 88.32 16.76 58.48 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 114.762 -1.108 . . . . 0.23 111.591 -178.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -65.69 -41.43 92.39 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.052 -0.722 . . . . 1.73 109.052 175.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.6 tttt -91.98 140.86 29.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.03 -0.987 . . . . 1.91 108.361 171.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.437 HG21 ' HG2' ' A' ' 30' ' ' ARG . 11.1 p -148.48 135.96 13.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.812 0.339 . . . . 1.04 110.639 -178.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -143.65 124.99 14.65 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.966 -0.383 . . . . 0.54 109.966 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.3 m -110.81 141.14 44.55 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.144 0.424 . . . . 1.04 112.144 -173.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.49 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -111.09 129.22 66.76 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 N-CA-C 108.037 -1.097 . . . . 1.04 108.037 168.163 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.447 ' O ' HG12 ' A' ' 45' ' ' ILE . 94.3 t -93.01 121.41 43.68 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 O-C-N 120.991 -1.068 . . . . 1.02 108.973 173.347 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.431 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.8 mm? -68.75 -21.22 64.38 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.098 0.777 . . . . 1.01 113.098 -169.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 p -68.23 -15.98 63.79 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.383 0.611 . . . . 1.07 109.386 175.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.471 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 5.1 p -111.18 14.29 21.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.395 -0.82 . . . . 1.03 110.079 -178.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.496 HG23 ' CD1' ' A' ' 62' ' ' LEU . 25.3 mm -112.41 139.05 39.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.961 -0.755 . . . . 1.01 108.961 177.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -105.23 -43.84 4.91 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.181 -0.463 . . . . 0.52 110.586 -175.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.452 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 26.7 mtpt -133.07 169.09 17.34 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 121.334 0.588 . . . . 1.95 111.292 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.494 ' CD1' HD13 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -150.77 146.34 26.33 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.909 -1.041 . . . . 1.39 108.998 176.57 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.667 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 11.6 mm-40 -134.5 145.23 48.59 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.979 -0.378 . . . . 2.02 109.979 -173.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.502 ' HB1' ' HD3' ' A' ' 101' ' ' LYS . . . -142.12 132.69 25.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 118.135 0.425 . . . . 1.05 111.032 174.136 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.471 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 82.6 p -64.98 118.03 45.03 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.508 -0.769 . . . . 1.05 110.704 -176.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -54.86 160.23 7.99 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 123.057 2.505 . . . . 0.44 112.34 177.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.03 -12.87 61.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.06 -0.518 . . . . 1.21 111.438 -178.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.9 m -89.16 -19.23 25.73 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.219 0.533 . . . . 1.94 110.558 174.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.9 m -72.57 141.3 48.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.553 -0.749 . . . . 1.13 111.005 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.5 -6.42 19.55 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.408 -0.815 . . . . 1.77 111.151 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.474 ' HG2' ' HE2' ' A' ' 59' ' ' MET . 9.0 mptt -107.65 159.81 16.18 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.957 -1.02 . . . . 2.18 111.716 -175.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.471 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 3.1 mtp -131.91 98.3 4.41 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 114.636 -1.165 . . . . 1.11 108.778 168.657 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.474 ' HE2' ' HG2' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -154.89 155.36 34.19 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.727 -0.67 . . . . 1.05 112.15 -172.364 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.454 ' HA ' ' O ' ' A' ' 49' ' ' GLN . 1.4 tt -135.11 119.05 17.36 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.659 -1.155 . . . . 1.05 108.302 177.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.676 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 6.4 mtp180 -104.25 138.04 41.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.232 0.539 . . . . 3.5 111.171 -178.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.548 ' HB2' ' HB2' ' A' ' 87' ' ' HIS . 1.6 mm? -115.9 106.02 13.34 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.34 -0.845 . . . . 1.03 109.252 176.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.536 ' N ' HD13 ' A' ' 63' ' ' ILE . 3.0 mp -88.67 108.33 18.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 110.318 -0.253 . . . . 1.11 110.318 -173.6 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.578 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -63.58 157.82 40.81 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.135 -0.555 . . . . 0.54 112.659 179.14 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.471 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 82.8 mttt -75.52 147.14 39.98 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.018 0.437 . . . . 1.08 111.184 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.529 ' CG2' ' HG3' ' A' ' 84' ' ' PRO . 1.7 t -101.28 141.87 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-N 115.782 -0.644 . . . . 2.32 111.13 -175.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.436 ' HB2' ' HD2' ' A' ' 70' ' ' LYS . 23.8 m-20 -107.18 81.8 1.59 Allowed 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.156 -1.053 . . . . 3.23 108.156 167.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -70.26 -2.84 14.56 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.249 0.547 . . . . 2.39 111.044 -174.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.3 p -91.37 -3.72 56.46 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.621 -0.718 . . . . 3.2 110.601 173.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 8.5 ptmm? -83.19 27.89 0.55 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.206 -0.452 . . . . 2.95 110.459 -177.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.53 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 29.3 mmtm -44.86 113.38 0.55 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.542 -0.754 . . . . 3.72 110.94 -170.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.418 ' HB3' HG22 ' A' ' 80' ' ' VAL . 72.3 ttt180 -98.04 165.93 11.67 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 108.174 -1.047 . . . . 4.12 108.174 178.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 63.1 mttp -134.01 140.83 46.96 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.704 -0.48 . . . . 4.59 109.704 172.57 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.487 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.5 OUTLIER -79.09 -172.07 2.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.642 -0.708 . . . . 4.41 110.057 -178.237 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.408 ' N ' HD21 ' A' ' 75' ' ' ASN . 0.9 OUTLIER -62.15 -31.84 72.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.616 0.246 . . . . 5.69 111.327 -179.109 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.487 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 26.0 mt-10 -78.79 -31.53 46.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.701 0.286 . . . . 5.38 110.798 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 114.65 17.09 7.16 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.786 -0.721 . . . . 4.47 112.635 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.579 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 38.1 m-80 -74.07 134.05 42.92 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.571 -0.529 . . . . 4.72 109.571 177.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -72.01 91.41 1.22 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.568 -0.53 . . . . 4.28 109.568 178.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.513 ' HB ' ' HA ' ' B' ' 525' ' ' ASN . 27.2 m -93.25 100.76 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.902 0 CA-C-O 122.035 0.922 . . . . 3.51 109.885 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.53 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.5 p -94.82 106.27 23.75 Favored Pre-proline 0 C--N 1.319 -0.73 0 CA-C-N 115.554 -0.748 . . . . 2.87 109.612 177.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.624 ' HA ' ' O ' ' B' ' 525' ' ' ASN . 36.6 Cg_exo -64.04 143.41 84.67 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 123.366 2.711 . . . . 2.06 113.212 -171.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.539 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -87.67 167.79 19.37 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 114.795 -1.093 . . . . 3.13 110.331 -177.273 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.578 ' HB3' ' O ' ' A' ' 64' ' ' GLY . 11.3 Cg_exo -58.46 148.28 81.46 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.089 1.86 . . . . 0.99 112.837 -178.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -92.32 115.85 28.45 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.492 -0.777 . . . . 2.11 109.377 175.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.523 ' HG2' HG13 ' A' ' 63' ' ' ILE . 31.3 mtm-85 -104.67 120.96 42.56 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 114.962 -1.017 . . . . 3.17 110.453 -172.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.548 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 52.9 m-70 -96.24 110.2 22.54 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.974 -0.75 . . . . 0.72 108.974 -176.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.676 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 24.1 ttm -108.27 118.97 38.16 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 119.898 -0.721 . . . . 1.07 111.341 -177.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.471 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.3 m-85 -109.53 128.54 55.27 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.2 -0.909 . . . . 0.27 109.905 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.6 OUTLIER -81.59 151.09 27.83 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 110.038 -0.356 . . . . 1.68 110.038 176.058 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -130.54 174.43 9.9 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.362 0.601 . . . . 0.32 111.69 -173.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -115.42 -19.54 10.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.103 -0.953 . . . . 2.7 110.878 177.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 -142.61 133.56 25.71 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.423 0.63 . . . . 1.16 110.926 -178.306 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.461 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.7 mmm180 -61.46 -35.52 77.86 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.713 -1.131 . . . . 3.7 112.063 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.9 m -62.85 -34.14 76.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.735 0.302 . . . . 1.13 110.775 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.535 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.0 t -69.2 -57.06 9.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.299 -0.41 . . . . 1.06 110.328 178.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.461 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 12.6 ptp -57.96 -38.69 76.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.056 -0.52 . . . . 1.02 111.39 -176.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -67.63 -37.46 82.49 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.996 -0.282 . . . . 0.34 110.297 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.4 ' HA ' ' HE3' ' A' ' 102' ' ' MET . 4.2 m-80 -72.56 -43.03 64.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.242 -0.435 . . . . 1.58 111.163 178.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.551 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 32.4 mm -62.42 -56.62 16.41 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 N-CA-C 108.849 -0.797 . . . . 1.01 108.849 177.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.502 ' HD3' ' HB1' ' A' ' 50' ' ' ALA . 12.3 ttpp -51.34 -46.24 62.6 Favored 'General case' 0 C--O 1.22 -0.481 0 O-C-N 123.693 0.621 . . . . 1.47 110.112 177.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.637 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 38.2 ttp -50.3 -59.69 3.72 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.669 -0.696 . . . . 1.02 111.175 177.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.77 ' O ' HG13 ' A' ' 107' ' ' ILE . 35.5 m -57.39 -52.81 63.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.212 -0.449 . . . . 1.04 110.546 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 26.4 mt -45.8 -55.35 6.7 Favored 'General case' 0 C--O 1.223 -0.336 0 O-C-N 123.685 0.615 . . . . 1.04 110.313 174.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -55.75 -43.93 77.13 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.877 -1.056 . . . . 1.96 112.484 177.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.637 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.4 mt-30 -62.12 -32.43 73.0 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.877 0.846 . . . . 3.11 108.862 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.77 HG13 ' O ' ' A' ' 103' ' ' THR . 9.8 mt -78.63 -46.68 24.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 114.284 -1.325 . . . . 1.03 111.116 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.527 HG13 ' O ' ' A' ' 104' ' ' LEU . 7.9 mt -61.8 -39.52 83.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.074 -0.512 . . . . 1.04 111.675 -177.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.0 t -60.17 -26.82 66.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.653 0.263 . . . . 1.67 111.065 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -65.64 -43.82 88.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.537 0.684 . . . . 1.99 109.249 174.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -91.53 12.04 22.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 1.0 109.759 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? -94.53 -40.6 9.79 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.75 -1.113 . . . . 1.46 108.118 173.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -77.39 -28.48 52.81 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.802 -1.09 . . . . 2.27 110.39 174.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -101.12 30.76 3.95 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.996 -0.547 . . . . 1.47 111.203 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 20.4 t70 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.269 -0.872 . . . . 2.72 109.776 178.73 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.661 0 N-CA-C 111.932 -0.467 . . . . 20.26 111.932 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 50.9 m 53.86 72.24 1.17 Allowed Pre-proline 0 C--O 1.234 0.285 0 CA-C-O 121.213 0.53 . . . . 18.54 111.424 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -81.63 160.53 19.25 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.871 2.381 . . . . 17.79 112.045 -178.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -82.11 2.16 84.96 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 111.421 -0.672 . . . . 16.44 111.421 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 62.58 72.64 0.59 Allowed Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 123.28 0.632 . . . . 16.12 111.327 177.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -87.28 22.09 0.97 Allowed 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.957 2.438 . . . . 13.81 112.02 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . 0.624 ' O ' ' HA ' ' A' ' 82' ' ' PRO . 92.1 m-20 -80.43 55.44 2.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.908 -0.587 . . . . 12.88 110.57 -177.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 98.36 124.0 4.93 Favored Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 111.054 -0.819 . . . . 9.73 111.054 -174.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . 0.405 ' C ' HD21 ' B' ' 527' ' ' LEU . 5.4 tt 67.83 90.96 0.09 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.302 0.572 . . . . 8.74 109.518 -174.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 3.0 tt -104.81 77.01 1.31 Allowed 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 108.26 -1.015 . . . . 10.79 108.26 174.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 16.0 m 57.33 66.63 1.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.343 -0.844 . . . . 7.62 110.703 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -99.98 -99.02 2.25 Favored Glycine 0 N--CA 1.444 -0.827 0 C-N-CA 120.545 -0.836 . . . . 5.26 112.394 -177.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -135.43 -11.95 2.11 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.332 0.587 . . . . 5.5 111.062 -176.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -105.39 22.4 15.5 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 122.214 1.007 . . . . 5.68 110.218 -178.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.65 -41.52 88.12 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 113.986 -1.461 . . . . 3.22 111.736 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -68.96 -37.98 79.12 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.112 0.482 . . . . 5.14 110.592 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 3.2 p -76.04 -11.24 59.91 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.745 -0.661 . . . . 1.34 111.146 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 74.6 m -84.61 -37.62 20.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.183 0.516 . . . . 2.43 110.432 173.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 23.3 mm -74.85 -34.36 33.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.035 0.445 . . . . 1.69 110.155 175.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -78.26 4.37 12.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.249 0.547 . . . . 1.36 110.76 175.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.424 ' HB2' ' NH1' ' A' ' 61' ' ' ARG . 28.0 t70 -90.18 -40.41 12.22 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.691 -0.686 . . . . 1.23 109.397 174.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 36.7 mtm -55.95 -32.23 63.67 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 115.171 -0.922 . . . . 2.83 109.857 174.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . 0.517 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 3.8 t70 -56.45 -44.16 80.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.716 -1.129 . . . . 1.18 110.749 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -31.89 73.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.588 -0.733 . . . . 0.66 112.052 -171.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 10.3 t -64.89 -29.57 70.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.004 0.431 . . . . 2.08 110.357 -178.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -91.32 -8.54 47.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.086 -0.506 . . . . 1.34 110.838 178.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 78.3 mt -87.8 -37.22 16.77 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.262 -0.426 . . . . 1.82 112.018 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 82.8 mt -71.54 -37.71 71.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.463 0.649 . . . . 1.54 109.695 177.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 2.9 p -118.21 89.96 3.23 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.949 -1.023 . . . . 1.92 109.93 175.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -85.88 64.1 8.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.658 -0.701 . . . . 3.31 111.411 -173.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 37.9 pt -87.41 -8.5 11.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.944 -0.571 . . . . 5.68 110.69 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 48.2 p -98.61 -5.13 32.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.104 0.478 . . . . 6.4 110.296 176.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 14.1 m . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.858 -0.592 . . . . 7.59 110.139 -179.432 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo . . . . . 0 N--CA 1.479 0.662 0 N-CA-C 110.378 -0.662 . . . . 2.47 110.378 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.7 p -92.14 -74.7 0.51 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.457 0.169 . . . . 2.05 111.457 -178.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.537 ' CD2' HG21 ' A' ' 103' ' ' THR . 75.3 m80 62.19 6.83 1.95 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.21 0.604 . . . . 1.08 111.656 -174.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 p -158.68 165.86 33.39 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.085 -0.646 . . . . 1.78 112.171 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.481 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 175.57 -165.77 36.78 Favored Glycine 0 N--CA 1.44 -1.081 0 CA-C-N 114.971 -1.013 . . . . 0.16 110.915 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.3 134.1 46.13 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 117.153 0.476 . . . . 1.04 110.009 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -146.56 148.61 32.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.623 -0.262 . . . . 1.02 111.656 -176.071 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.773 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 61.6 mt -109.39 122.83 64.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.952 0.406 . . . . 1.17 110.719 176.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.408 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.3 t80 -125.59 134.16 52.02 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.785 -0.82 . . . . 0.43 108.785 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 59.52 26.61 15.62 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.777 0.431 . . . . 0.8 110.543 -177.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt 69.56 1.06 3.19 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.825 0.85 . . . . 2.57 113.125 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.408 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.5 OUTLIER -92.45 123.77 44.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 108.418 -0.956 . . . . 1.1 108.418 167.842 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.3 m -75.9 145.77 40.24 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.901 0.381 . . . . 1.5 110.234 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.6 -160.82 11.17 Favored Glycine 0 N--CA 1.437 -1.297 0 C-N-CA 120.317 -0.944 . . . . 0.12 112.944 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.5 mm -125.28 135.04 65.29 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.217 -0.661 . . . . 1.02 109.217 -178.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.449 HD13 HD13 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -104.08 135.5 41.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 110.133 -0.321 . . . . 1.05 110.133 -175.493 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.69 129.2 30.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.928 0.394 . . . . 1.04 111.594 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.501 HD13 ' HA ' ' A' ' 3' ' ' HIS . 58.5 mt -86.11 134.98 26.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 109.812 -0.44 . . . . 1.04 109.812 177.589 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -111.33 103.57 11.97 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.245 -0.434 . . . . 1.98 111.303 -173.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 30.9 mt-10 -114.95 170.32 8.43 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.435 -0.95 . . . . 1.2 108.435 173.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.1 t70 80.77 -5.84 1.69 Allowed 'General case' 0 N--CA 1.484 1.225 0 CA-C-O 122.393 1.092 . . . . 0.58 109.472 -176.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 23' ' ' SER . 26.4 m -102.74 -173.18 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-N 113.732 -1.576 . . . . 1.05 109.107 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.618 ' O ' HG22 ' A' ' 22' ' ' VAL . 30.5 m -72.15 168.12 25.95 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 105.549 -2.019 . . . . 1.77 105.549 175.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.401 ' O ' HG12 ' A' ' 41' ' ' VAL . 68.8 Cg_exo -40.76 128.36 2.64 Favored 'Trans proline' 0 C--N 1.359 1.095 0 CA-C-N 121.288 1.496 . . . . 0.19 112.518 -145.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.411 ' HB2' ' CG2' ' A' ' 107' ' ' ILE . . . -49.24 140.39 9.9 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 114.215 -1.357 . . . . 1.03 112.534 -164.042 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.29 166.47 15.84 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.353 -1.294 . . . . 0.32 111.862 -170.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.504 ' HB3' HG23 ' A' ' 40' ' ' VAL . 3.2 tm? -115.84 107.3 14.85 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 107.633 -1.247 . . . . 1.02 107.633 173.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.1 m -104.16 106.94 17.62 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 120.82 0.343 . . . . 1.02 111.301 -174.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.41 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 86.2 t90 -85.21 130.44 34.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.942 -0.762 . . . . 0.17 108.942 172.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HG2' HG21 ' A' ' 37' ' ' VAL . 61.4 mtt180 -125.16 156.7 37.98 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 108.77 -0.826 . . . . 2.24 108.77 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -66.0 174.47 2.47 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.301 -0.629 . . . . 0.63 109.301 178.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.1 p -58.02 -36.92 73.38 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.408 -0.517 . . . . 0.96 110.681 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -87.67 -32.26 19.32 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.558 0.694 . . . . 2.12 109.716 172.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 100.29 12.78 37.93 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 114.922 -1.036 . . . . 0.23 112.825 176.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -66.68 -36.53 82.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.36 0.6 . . . . 1.73 109.895 176.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -95.68 137.82 34.2 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.414 -0.958 . . . . 1.91 108.414 174.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.444 HG21 ' HG2' ' A' ' 30' ' ' ARG . 14.6 p -150.48 136.31 11.54 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-O 120.994 0.426 . . . . 1.04 111.391 -177.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -143.71 128.8 18.64 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.634 -0.506 . . . . 0.54 109.634 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.408 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 30.4 m -114.37 140.86 48.31 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.033 0.383 . . . . 1.04 112.033 -172.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.504 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -107.89 128.97 62.77 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 N-CA-C 108.18 -1.044 . . . . 1.04 108.18 168.383 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.436 ' O ' HG12 ' A' ' 45' ' ' ILE . 99.8 t -92.3 118.78 38.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 121.228 -0.92 . . . . 1.02 108.963 173.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.421 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.8 mm? -67.56 -18.55 65.05 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.866 0.691 . . . . 1.01 112.866 -170.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.512 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 80.4 p -68.18 -18.3 64.56 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.177 -0.675 . . . . 1.07 109.177 176.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.9 p -109.99 13.21 23.45 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.886 -1.052 . . . . 1.03 110.206 -177.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.546 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 27.4 mm -111.63 140.47 30.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.054 -0.521 . . . . 1.01 109.657 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -106.86 -43.99 4.54 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.882 -0.599 . . . . 0.52 110.839 -175.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.518 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 40.4 mtpt -133.57 172.26 12.98 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.411 0.624 . . . . 1.95 111.537 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.495 ' CD2' ' HB3' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -151.08 148.95 28.94 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.939 -1.028 . . . . 1.39 108.882 174.8 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.502 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 5.4 mm-40 -136.34 153.36 51.16 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.381 -0.6 . . . . 2.02 109.381 -176.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.449 ' HB2' ' SD ' ' A' ' 97' ' ' MET . . . -145.66 140.36 27.24 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 118.278 0.49 . . . . 1.05 110.917 176.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 76.2 p -71.08 118.21 63.56 Favored Pre-proline 0 C--O 1.234 0.258 0 CA-C-N 116.134 -0.485 . . . . 1.05 111.272 -176.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.483 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 17.4 Cg_exo -56.82 160.69 11.62 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.867 2.378 . . . . 0.44 112.299 177.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.56 -20.88 66.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.697 -0.683 . . . . 1.21 111.871 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.8 m -85.9 -18.07 33.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.203 0.525 . . . . 1.94 111.067 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.483 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 35.1 m -68.93 143.34 54.48 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.527 -0.76 . . . . 1.13 112.263 -177.342 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -58.18 -26.76 63.15 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 114.639 -1.164 . . . . 1.77 110.975 171.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.433 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 68.1 mmtt -91.73 153.05 19.89 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.948 -1.478 . . . . 2.18 111.984 -169.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.602 ' O ' ' HG3' ' A' ' 59' ' ' MET . 80.0 mmm -127.16 96.16 4.51 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.317 -0.994 . . . . 1.11 108.317 167.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.602 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -158.52 158.34 33.83 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.581 0.705 . . . . 1.05 112.226 -173.326 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.473 HD12 ' O ' ' A' ' 97' ' ' MET . 2.4 tt -135.43 120.62 18.91 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.662 -1.154 . . . . 1.05 108.121 176.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.606 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 1.0 OUTLIER -102.94 146.34 28.47 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.307 0.575 . . . . 3.5 111.591 -177.697 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.513 HD22 HD12 ' A' ' 104' ' ' LEU . 1.2 mm? -125.62 106.18 9.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.847 -1.07 . . . . 1.03 108.952 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.518 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.4 mp -87.73 105.85 15.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-O 120.695 0.283 . . . . 1.11 110.532 -172.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.522 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -74.89 147.66 36.93 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.306 -0.474 . . . . 0.54 113.062 -177.136 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.546 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 90.1 mttt -66.98 127.62 33.24 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 122.922 0.489 . . . . 1.08 111.945 -178.228 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.622 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.6 t -120.23 142.1 37.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.792 -0.64 . . . . 2.32 110.658 177.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.624 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 4.7 m-20 -86.46 82.6 7.89 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.835 -0.802 . . . . 3.23 108.835 175.244 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.69 -6.34 7.65 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.328 0.492 . . . . 2.39 112.328 -172.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.0 p -69.39 -8.45 46.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.387 0.613 . . . . 3.2 110.106 172.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.2 ptpt -82.92 33.21 0.43 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.489 -0.778 . . . . 2.95 111.226 178.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.1 mtmm -46.63 114.21 0.78 Allowed 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.277 -0.638 . . . . 3.72 109.277 -177.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.502 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.8 ttt180 -96.65 161.55 13.84 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.012 -0.994 . . . . 4.12 109.005 -168.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 98.8 mttt -129.23 146.56 51.11 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 109.669 -0.493 . . . . 4.59 109.669 173.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.48 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 1.1 p-10 -81.48 -168.85 2.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.993 -0.549 . . . . 4.41 110.52 -177.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -59.37 -32.04 69.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.665 -0.243 . . . . 5.69 111.629 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.48 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 16.5 mt-10 -82.67 -41.51 19.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.093 0.473 . . . . 5.38 110.648 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 127.12 16.0 2.45 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.737 -0.744 . . . . 4.47 112.145 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.558 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 37.1 m-80 -73.11 138.18 45.65 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.63 -0.507 . . . . 4.72 109.63 178.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -75.14 93.32 2.77 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.203 -0.453 . . . . 4.28 110.401 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.502 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 14.7 m -103.91 99.45 8.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.466 0.65 . . . . 3.51 109.309 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.0 p -92.41 111.84 52.49 Favored Pre-proline 0 C--N 1.316 -0.889 0 CA-C-O 121.366 0.603 . . . . 2.87 110.655 -177.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.418 ' HD3' ' O ' ' A' ' 80' ' ' VAL . 39.1 Cg_exo -62.39 132.81 40.02 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 123.114 2.543 . . . . 2.06 112.082 -178.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.407 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 48.0 mtmt -94.02 161.55 29.46 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 115.174 -0.921 . . . . 3.13 109.655 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.622 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 32.4 Cg_exo -48.24 146.09 10.28 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.55 2.167 . . . . 0.99 112.323 179.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -90.04 115.85 27.63 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.491 -0.777 . . . . 2.11 109.891 -173.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.508 ' HG2' HG13 ' A' ' 63' ' ' ILE . 62.5 mtt180 -98.99 126.48 44.7 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 115.237 -0.892 . . . . 3.17 110.963 -171.189 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 75.1 m-70 -94.55 147.54 23.17 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 107.217 -1.401 . . . . 0.72 107.217 177.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.606 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 26.6 ttm -141.94 131.84 24.41 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 119.033 0.833 . . . . 1.07 111.204 175.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.492 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.5 m-85 -120.97 134.64 55.3 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.471 -0.786 . . . . 0.27 109.529 178.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.773 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -79.99 159.39 26.27 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.507 -0.553 . . . . 1.68 109.507 178.071 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.423 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 16.7 m-85 -138.4 175.16 9.81 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.349 0.595 . . . . 0.32 112.151 -177.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.1 p-10 -116.94 -20.55 9.34 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.111 -0.95 . . . . 2.7 110.843 178.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -145.87 143.77 29.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.91 0.385 . . . . 1.16 110.451 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.523 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.2 OUTLIER -73.84 -28.56 61.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.831 -0.622 . . . . 3.7 111.835 -176.739 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.3 m -63.9 -38.53 91.41 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.757 0.313 . . . . 1.13 110.823 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.516 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.2 t -63.55 -56.85 14.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.324 -0.398 . . . . 1.06 110.273 178.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.523 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 15.7 ptp -58.58 -39.54 80.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.834 -0.621 . . . . 1.02 111.21 -176.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.7 -41.0 98.9 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 120.675 -0.41 . . . . 0.34 110.331 177.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -71.17 -39.29 71.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.271 -0.422 . . . . 1.58 111.71 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.543 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 34.2 mm -64.99 -56.2 16.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 108.858 -0.793 . . . . 1.01 108.858 175.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.543 ' HE3' ' NE2' ' A' ' 105' ' ' GLN . 31.8 ttpt -51.57 -45.62 63.16 Favored 'General case' 0 C--O 1.223 -0.293 0 O-C-N 123.911 0.757 . . . . 1.47 110.232 177.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.476 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 41.3 ttp -51.87 -54.18 32.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.28 -0.873 . . . . 1.02 111.099 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.715 ' O ' HG13 ' A' ' 107' ' ' ILE . 24.4 m -62.33 -52.16 64.76 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.179 -0.464 . . . . 1.04 110.395 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 27.0 mt -46.97 -54.5 10.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.737 -0.665 . . . . 1.04 110.522 175.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.543 ' NE2' ' HE3' ' A' ' 101' ' ' LYS . 43.8 mt-30 -52.59 -46.39 66.92 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.826 -1.079 . . . . 1.96 112.239 176.595 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 102' ' ' MET . 13.7 mm100 -64.14 -27.93 69.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.671 0.748 . . . . 3.11 110.287 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 103' ' ' THR . 7.2 mt -81.08 -41.05 18.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 114.737 -1.119 . . . . 1.03 110.798 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 104' ' ' LEU . 6.3 mt -67.29 -38.63 81.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.354 -0.385 . . . . 1.04 111.84 -178.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.2 p -59.97 -24.92 64.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.014 0.435 . . . . 1.67 111.202 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 -62.25 -52.31 64.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.608 0.718 . . . . 1.99 109.55 172.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.558 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 21.5 m-85 -85.7 18.37 2.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.02 -0.991 . . . . 1.0 110.472 177.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? -102.78 -41.51 6.17 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 107.842 -1.17 . . . . 1.46 107.842 171.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -72.44 -32.86 66.64 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.975 -1.011 . . . . 2.27 109.969 172.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -115.71 68.09 0.71 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.466 -0.788 . . . . 1.47 110.431 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.558 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 31.6 t70 . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.463 -0.779 . . . . 2.72 110.577 178.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.716 0 N-CA-C 111.992 -0.443 . . . . 20.26 111.992 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 61.4 m -130.66 88.7 45.84 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-O 120.922 0.392 . . . . 18.54 110.734 179.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -77.99 -21.76 10.6 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.551 2.167 . . . . 17.79 112.155 177.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 121.68 -166.82 14.42 Favored Glycine 0 N--CA 1.444 -0.818 0 N-CA-C 111.429 -0.668 . . . . 16.44 111.429 -176.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -110.55 104.04 55.25 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-O 120.706 0.289 . . . . 16.12 110.706 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.11 168.45 21.87 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.578 2.185 . . . . 13.81 112.077 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -97.73 61.83 1.61 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.103 -0.499 . . . . 12.88 110.747 -179.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -78.32 55.17 4.02 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.844 -0.616 . . . . 9.73 112.181 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 9.7 tt -146.58 -43.98 0.19 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.959 0.885 . . . . 8.74 109.599 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 97.4 mt -78.67 -4.84 51.06 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 114.136 -1.393 . . . . 10.79 110.451 176.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 20.9 p -141.18 -74.11 0.33 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.367 -0.833 . . . . 7.62 110.773 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 164.43 -84.23 0.11 Allowed Glycine 0 CA--C 1.499 -0.934 0 N-CA-C 110.959 -0.857 . . . . 5.26 110.959 176.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -146.03 9.53 1.13 Allowed 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.532 -0.834 . . . . 5.5 110.344 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -87.03 -2.47 58.65 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.727 0.775 . . . . 5.68 110.993 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -80.9 3.39 22.91 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.615 -1.175 . . . . 3.22 110.582 -176.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -63.33 -22.88 67.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.62 0.724 . . . . 5.14 109.531 175.578 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 34.7 p -74.7 -21.48 59.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.795 -1.093 . . . . 1.34 110.387 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 536' ' ' SER . . . . . 0.453 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 31.5 t -74.64 -36.53 62.88 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.235 0.54 . . . . 2.43 110.137 178.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 31.3 mm -74.63 -41.09 48.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.949 -0.569 . . . . 1.69 110.186 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -74.94 5.58 4.98 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.665 0.745 . . . . 1.36 110.512 176.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.527 ' HB2' ' NH1' ' A' ' 61' ' ' ARG . 34.8 t70 -92.18 -44.96 8.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.117 -0.947 . . . . 1.23 109.653 174.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 33.0 mtm -59.84 -31.96 70.22 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.052 -0.976 . . . . 2.83 109.491 174.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -51.41 -48.24 62.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.593 -1.185 . . . . 1.18 110.648 174.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.52 -35.53 76.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.324 -0.853 . . . . 0.66 112.164 -173.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 13.3 t -62.5 -46.43 88.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.85 0.357 . . . . 2.08 110.804 -175.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -77.35 -21.83 52.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.096 0.474 . . . . 1.34 110.255 177.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 18.1 tp -75.6 -37.83 59.53 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.58 -0.736 . . . . 1.82 111.2 -175.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 85.5 mt -75.68 -25.31 56.62 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.553 0.692 . . . . 1.54 109.386 174.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 16.3 m -87.98 31.67 0.78 Allowed 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.974 -1.012 . . . . 1.92 110.896 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -91.39 -16.76 26.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.395 0.617 . . . . 3.31 110.548 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 1.1 tp -101.25 123.26 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.072 0 CA-C-N 115.344 -0.844 . . . . 5.68 110.207 -178.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.8 t 60.42 79.74 0.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.625 -0.716 . . . . 6.4 110.96 177.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 69.4 m . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.335 -0.841 . . . . 7.59 110.612 178.343 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo . . . . . 0 C--O 1.232 0.202 0 N-CA-C 110.558 -0.593 . . . . 2.47 110.558 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 m -64.11 107.79 1.37 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.584 0.707 . . . . 2.05 111.794 -174.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.567 ' CD2' HG23 ' A' ' 103' ' ' THR . 56.2 m80 -89.67 8.26 32.46 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.07 -0.968 . . . . 1.08 109.624 171.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.9 p -157.71 168.54 26.93 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.604 -0.839 . . . . 1.78 112.785 -176.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.42 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 173.54 -163.43 34.74 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 110.116 -1.194 . . . . 0.16 110.116 -178.339 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -100.29 135.66 41.38 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 117.513 0.657 . . . . 1.04 110.167 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -145.43 152.27 39.56 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.42 -0.355 . . . . 1.02 110.859 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.0 mt -111.7 122.21 65.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.446 -0.343 . . . . 1.17 110.465 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.489 ' O ' HG11 ' A' ' 12' ' ' VAL . 32.4 t80 -126.17 132.6 51.78 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.218 -0.66 . . . . 0.43 109.218 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 58.98 28.16 17.3 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.037 0.535 . . . . 0.8 110.328 -176.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt 69.34 0.77 3.01 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.015 0.746 . . . . 2.57 113.015 178.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.489 HG11 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -91.45 121.69 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 108.047 -1.094 . . . . 1.1 108.047 167.077 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.7 m -75.61 145.22 41.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.095 -0.502 . . . . 1.5 110.21 -177.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.443 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.33 -156.81 8.46 Favored Glycine 0 N--CA 1.436 -1.363 0 C-N-CA 120.078 -1.058 . . . . 0.12 113.482 -177.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 15.8 mm -125.44 132.31 71.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 C-N-CA 123.217 0.607 . . . . 1.02 109.429 -177.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.428 HD13 HD12 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.73 135.96 38.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.704 -0.48 . . . . 1.05 109.704 -177.483 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.87 130.87 32.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.808 0.337 . . . . 1.04 111.264 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.509 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 52.8 mt -86.16 138.12 19.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 109.685 -0.487 . . . . 1.04 109.685 177.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -111.22 103.16 11.55 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.137 -0.483 . . . . 1.98 111.091 -174.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.409 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 31.1 mt-10 -115.94 170.36 8.54 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.163 -0.68 . . . . 1.2 109.163 175.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.409 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 26.5 t70 77.26 -3.28 2.49 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.37 1.081 . . . . 0.58 109.583 -178.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.615 HG22 ' O ' ' A' ' 23' ' ' SER . 32.8 m -103.0 -173.92 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.046 0 CA-C-N 113.885 -1.507 . . . . 1.05 109.798 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.615 ' O ' HG22 ' A' ' 22' ' ' VAL . 53.6 m -73.01 166.52 42.72 Favored Pre-proline 0 C--N 1.315 -0.896 0 N-CA-C 105.211 -2.144 . . . . 1.77 105.211 173.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -41.34 128.52 3.26 Favored 'Trans proline' 0 C--N 1.355 0.902 0 CA-C-N 121.037 1.406 . . . . 0.19 112.738 -141.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.422 ' HB1' HG21 ' A' ' 107' ' ' ILE . . . -50.21 142.18 10.26 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 114.105 -1.407 . . . . 1.03 112.593 -165.317 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -127.74 169.4 13.89 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 114.447 -1.251 . . . . 0.32 111.985 -168.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.487 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.3 tm? -120.46 107.25 12.66 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 107.939 -1.134 . . . . 1.02 107.939 174.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.8 m -101.42 108.53 20.16 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 116.427 -0.351 . . . . 1.02 111.193 -175.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -85.3 131.13 34.46 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.853 -0.795 . . . . 0.17 108.853 170.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.496 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 89.1 mtt180 -122.26 151.12 41.41 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.628 -0.878 . . . . 2.24 108.628 172.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.649 ' OG ' ' HB3' ' A' ' 36' ' ' LYS . 2.8 m -61.99 172.49 1.36 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.16 -0.311 . . . . 0.63 110.16 173.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.443 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.1 p -60.02 -36.13 76.58 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.218 -0.593 . . . . 0.96 110.62 178.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -86.17 -14.68 43.33 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.397 -0.594 . . . . 2.12 109.397 175.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.496 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 76.99 19.51 77.35 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.147 -0.933 . . . . 0.23 112.513 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -84.37 -35.43 23.19 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.533 -0.914 . . . . 1.73 108.533 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.649 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 43.7 tttp -90.68 141.09 29.15 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.18 -1.373 . . . . 1.91 108.59 172.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.444 HG22 ' HG2' ' A' ' 30' ' ' ARG . 9.5 p -150.28 138.56 14.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 C-N-CA 120.834 -0.346 . . . . 1.04 111.066 -176.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -145.07 125.02 13.48 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.973 -0.38 . . . . 0.54 109.973 175.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 31.7 m -110.67 137.11 48.76 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.104 0.409 . . . . 1.04 112.104 -174.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.487 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.37 129.53 56.58 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 N-CA-C 108.117 -1.068 . . . . 1.04 108.117 168.636 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.9 t -93.15 121.66 44.02 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 O-C-N 121.23 -0.919 . . . . 1.02 108.926 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.447 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.6 mm? -68.71 -18.56 64.27 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.104 0.779 . . . . 1.01 113.104 -169.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.7 p -72.0 -11.93 61.0 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.066 -0.654 . . . . 1.07 109.75 175.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.2 p -111.31 13.07 21.66 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.345 -0.843 . . . . 1.03 109.624 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.459 HG22 ' CD1' ' A' ' 62' ' ' LEU . 26.8 mm -113.75 138.04 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-N 115.712 -0.676 . . . . 1.01 109.25 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -101.75 -42.56 6.13 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.094 -0.503 . . . . 0.52 110.456 -177.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.0 mtmm -142.17 172.7 12.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.306 -0.407 . . . . 1.95 111.012 -176.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.468 ' CD2' ' HB3' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -151.01 149.04 29.09 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.591 -0.892 . . . . 1.39 108.591 179.739 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.455 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 16.5 mm-40 -138.64 127.76 24.09 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 110.453 -0.203 . . . . 2.02 110.453 -175.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.5 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . . . -122.01 134.85 54.8 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.452 -0.78 . . . . 1.05 110.968 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.458 ' HB ' ' OG ' ' A' ' 55' ' ' SER . 69.1 p -63.37 115.39 17.71 Favored Pre-proline 0 C--O 1.234 0.247 0 CA-C-N 115.913 -0.585 . . . . 1.05 110.409 -175.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -54.98 158.95 10.31 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.953 2.436 . . . . 0.44 112.046 -179.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.94 -11.76 49.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.273 -0.421 . . . . 1.21 111.382 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.0 t -109.4 25.9 11.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.24 0.543 . . . . 1.94 110.358 176.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.458 ' OG ' ' HB ' ' A' ' 51' ' ' THR . 83.9 p -99.98 158.83 15.54 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.746 -0.464 . . . . 1.13 109.746 176.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -82.84 12.68 4.55 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 121.298 0.571 . . . . 1.77 110.516 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.504 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 42.9 mmtm -130.6 162.97 28.16 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.539 -0.755 . . . . 2.18 111.271 -171.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.463 ' O ' ' HG3' ' A' ' 59' ' ' MET . 3.5 mtp -136.9 97.95 3.65 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.997 -1.001 . . . . 1.11 108.826 167.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.504 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -156.81 155.13 31.01 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.556 -0.747 . . . . 1.05 111.41 -171.557 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.443 HD13 ' O ' ' A' ' 97' ' ' MET . 1.6 tt -131.94 119.03 20.57 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.383 -0.969 . . . . 1.05 108.383 176.269 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.6 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 6.9 mtp180 -102.82 146.04 28.87 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 121.423 0.63 . . . . 3.5 111.325 -179.011 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.536 HD23 HD12 ' A' ' 104' ' ' LEU . 1.3 mm? -125.63 104.72 8.53 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 114.524 -1.216 . . . . 1.03 108.787 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.547 ' N ' HD13 ' A' ' 63' ' ' ILE . 2.0 mp -85.66 102.3 11.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.724 0.297 . . . . 1.11 110.315 -172.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.473 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -63.94 152.96 48.18 Favored Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 115.854 -0.612 . . . . 0.54 112.455 178.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 76.8 mttt -75.5 115.25 14.97 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 121.436 0.636 . . . . 1.08 112.509 -175.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.684 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 3.9 t -123.15 137.76 55.45 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.14 0 CA-C-N 114.98 -1.009 . . . . 2.32 110.1 172.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.526 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 34.4 m-20 -99.24 91.47 4.98 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 108.359 -0.978 . . . . 3.23 108.359 173.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 82' ' ' PRO . 46.2 mt-10 -64.86 -1.18 1.82 Allowed 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 112.651 0.611 . . . . 2.39 112.651 -171.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.3 p -72.75 -9.18 58.35 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.401 0.62 . . . . 3.2 109.94 168.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.625 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 11.6 ptmm? -80.03 41.79 0.53 Allowed 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.261 -0.882 . . . . 2.95 111.051 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.419 ' HE2' ' OE1' ' A' ' 79' ' ' GLU . 18.9 mttp -43.41 117.39 1.11 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.562 -0.744 . . . . 3.72 111.411 -175.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.559 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 25.7 ttt180 -101.47 158.87 15.75 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.15 -0.932 . . . . 4.12 109.118 -175.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 94.1 mttt -131.54 146.67 52.33 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.361 -0.607 . . . . 4.59 109.361 171.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.472 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER -76.62 -174.33 2.92 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.194 -0.457 . . . . 4.41 110.229 -178.902 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -56.65 -32.94 65.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 111.801 0.297 . . . . 5.69 111.801 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.472 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 21.5 mt-10 -81.02 -46.52 14.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.833 0.349 . . . . 5.38 110.823 -178.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.01 13.66 1.17 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.669 -0.776 . . . . 4.47 112.494 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.403 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 37.8 m-80 -71.1 129.01 37.85 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.402 -0.592 . . . . 4.72 109.402 177.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.419 ' OE1' ' HE2' ' A' ' 71' ' ' LYS . 35.4 tt0 -70.05 101.85 1.91 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.099 0.476 . . . . 4.28 110.083 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.559 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 10.1 m -113.88 98.76 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 CA-C-O 121.818 0.818 . . . . 3.51 109.017 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.441 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.5 OUTLIER -87.74 112.64 50.09 Favored Pre-proline 0 C--N 1.311 -1.104 0 CA-C-N 115.762 -0.653 . . . . 2.87 110.035 -177.846 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.471 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 31.7 Cg_exo -63.39 132.52 36.23 Favored 'Trans proline' 0 CA--C 1.511 -0.628 0 C-N-CA 123.152 2.568 . . . . 2.06 112.636 -176.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -91.82 162.16 31.8 Favored Pre-proline 0 C--N 1.311 -1.082 0 CA-C-N 114.779 -1.1 . . . . 3.13 108.244 174.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.684 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 36.8 Cg_exo -55.89 147.39 62.74 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 121.944 1.763 . . . . 0.99 111.772 179.339 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -90.16 114.22 26.14 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-O 121.706 0.765 . . . . 2.11 109.137 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.426 ' HG2' HG13 ' A' ' 63' ' ' ILE . 94.0 mtt180 -104.89 125.75 51.24 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 114.999 -1.0 . . . . 3.17 110.282 -171.232 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.6 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 75.2 m-70 -94.04 144.8 25.16 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 107.022 -1.473 . . . . 0.72 107.022 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.584 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 25.2 ttm -139.99 124.96 18.51 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 119.056 0.844 . . . . 1.07 111.047 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.414 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.6 m-85 -113.95 128.72 56.52 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.166 -0.925 . . . . 0.27 109.443 178.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.6 OUTLIER -80.99 151.59 28.38 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.92 -0.4 . . . . 1.68 109.92 176.771 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -132.75 173.37 11.43 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.057 0.455 . . . . 0.32 110.809 -176.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -124.9 -6.29 7.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.5 -0.773 . . . . 2.7 109.424 172.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.2 m-80 -136.55 120.4 17.45 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.953 -0.567 . . . . 1.16 110.882 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.454 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.0 mmm180 -64.0 -35.58 81.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.344 -0.844 . . . . 3.7 111.872 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.2 m -63.17 -36.62 84.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.448 -0.342 . . . . 1.13 110.883 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.582 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.5 t -67.1 -57.19 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 CA-C-N 116.47 -0.332 . . . . 1.06 110.203 178.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.454 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 12.9 ptp -56.59 -37.84 71.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 1.02 111.363 -175.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.55 -43.18 85.78 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.602 -0.439 . . . . 0.34 110.765 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -69.5 -41.49 76.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.447 -0.342 . . . . 1.58 111.471 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.582 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.1 mm -62.45 -57.41 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 108.685 -0.857 . . . . 1.01 108.685 176.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.5 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 23.4 ttpp -50.12 -49.56 51.4 Favored 'General case' 0 C--O 1.218 -0.583 0 O-C-N 123.902 0.751 . . . . 1.47 110.164 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.688 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 37.4 ttp -48.76 -59.8 3.25 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 123.961 0.788 . . . . 1.02 111.391 177.428 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.779 ' O ' HG13 ' A' ' 107' ' ' ILE . 36.0 m -57.76 -50.46 73.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.304 -0.407 . . . . 1.04 110.335 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 35.3 mt -46.81 -55.77 7.38 Favored 'General case' 0 C--O 1.221 -0.404 0 O-C-N 123.744 0.652 . . . . 1.04 110.278 174.052 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.455 ' HG2' ' CD1' ' A' ' 48' ' ' LEU . 51.2 mt-30 -54.52 -44.95 73.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.913 -1.04 . . . . 1.96 112.134 177.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 102' ' ' MET . 22.6 mt-30 -61.82 -31.51 71.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.847 0.832 . . . . 3.11 108.956 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.779 HG13 ' O ' ' A' ' 103' ' ' THR . 8.6 mt -80.99 -43.75 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 114.584 -1.189 . . . . 1.03 111.163 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.553 HG13 ' O ' ' A' ' 104' ' ' LEU . 9.0 mt -63.95 -37.52 80.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.164 -0.471 . . . . 1.04 111.638 -177.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.6 t -55.4 -30.92 61.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.283 -0.417 . . . . 1.67 110.782 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -62.47 -41.61 98.89 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.264 0.554 . . . . 1.99 109.732 176.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.5 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 23.7 m-85 -97.73 18.73 15.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.701 -0.682 . . . . 1.0 109.963 179.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.1 -46.78 4.0 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.926 -1.138 . . . . 1.46 107.926 176.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -75.54 -13.96 60.38 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.577 -1.192 . . . . 2.27 109.993 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -128.88 71.88 1.44 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.424 -0.807 . . . . 1.47 110.195 176.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.5 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 31.3 t70 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.41 -0.805 . . . . 2.72 109.968 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 111.431 -0.668 . . . . 20.26 111.431 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 15.3 t -94.91 121.35 62.86 Favored Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 110.003 -0.369 . . . . 18.54 110.003 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.23 72.58 4.75 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 123.112 2.541 . . . . 17.79 112.655 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -179.93 -67.07 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 121.066 -0.588 . . . . 16.44 111.994 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -140.37 141.09 24.67 Favored Pre-proline 0 C--N 1.323 -0.544 0 N-CA-C 110.048 -0.353 . . . . 16.12 110.048 179.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -78.04 63.24 8.17 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 122.965 2.443 . . . . 13.81 112.815 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -81.28 149.9 28.77 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.019 -0.537 . . . . 12.88 109.702 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -98.08 92.74 1.29 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.777 -0.725 . . . . 9.73 112.611 -176.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . 0.425 ' N ' HD12 ' B' ' 527' ' ' LEU . 0.0 OUTLIER -111.42 29.66 7.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.082 0.467 . . . . 8.74 110.856 177.579 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 60.0 tp -75.65 83.72 2.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.895 -0.593 . . . . 10.79 111.305 -175.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 37.0 m 64.23 25.41 13.58 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.544 -0.753 . . . . 7.62 112.551 172.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -95.63 -100.79 1.84 Allowed Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.12 -1.038 . . . . 5.26 111.694 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -123.81 -28.6 3.8 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.827 0.822 . . . . 5.5 109.719 -178.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' B' ' 536' ' ' SER . 38.4 mt-10 -79.53 -9.31 59.59 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.662 -1.153 . . . . 5.68 109.449 178.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -63.96 -26.39 68.56 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 113.591 -1.641 . . . . 3.22 110.94 -177.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -102.07 -60.3 1.56 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.192 0.52 . . . . 5.14 111.435 -176.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 20.2 p -74.4 -19.86 60.26 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.621 -0.718 . . . . 1.34 112.753 -170.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 536' ' ' SER . . . . . 0.444 ' HB2' ' O ' ' B' ' 532' ' ' GLU . 50.4 m -79.76 -34.38 39.89 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.617 -0.433 . . . . 2.43 110.523 175.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 47.6 mm -73.75 -40.83 54.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.331 0.586 . . . . 1.69 109.727 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -78.85 -0.14 29.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.687 0.756 . . . . 1.36 110.394 177.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.508 ' HB2' ' NH1' ' A' ' 61' ' ' ARG . 10.7 t70 -86.76 -45.52 10.86 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.957 -1.02 . . . . 1.23 108.869 171.489 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 86.3 mtp -59.48 -34.5 72.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.64 -1.164 . . . . 2.83 110.011 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -57.53 -53.07 62.3 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.988 0.899 . . . . 1.18 110.022 173.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.435 ' HA ' HD13 ' B' ' 545' ' ' LEU . 0.2 OUTLIER -65.06 -45.91 83.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.057 -1.428 . . . . 0.66 111.727 -171.509 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 14.5 m -56.79 -28.24 61.05 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.982 -0.554 . . . . 2.08 112.152 -176.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -82.23 -20.91 36.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.372 -0.376 . . . . 1.34 110.929 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . 0.435 HD13 ' HA ' ' B' ' 542' ' ' PHE . 89.9 mt -78.86 -33.66 45.68 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.989 -0.55 . . . . 1.82 111.532 -176.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -63.16 -70.04 0.23 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.752 0.786 . . . . 1.54 110.212 175.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 12.9 p -71.99 59.93 0.38 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.201 -1.363 . . . . 1.92 112.251 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -98.48 7.22 46.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.108 0.48 . . . . 3.31 109.957 173.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 43.3 mt 61.52 66.75 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 115.208 -0.905 . . . . 5.68 109.764 -176.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.4 t -71.42 -39.65 70.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.271 -0.877 . . . . 6.4 110.125 -177.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 48.0 m . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.733 -0.651 . . . . 7.59 109.941 177.631 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo . . . . . 0 N--CA 1.478 0.595 0 N-CA-C 110.37 -0.666 . . . . 2.47 110.37 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.6 t -168.61 -41.14 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.938 0.399 . . . . 2.05 110.544 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.406 ' HA ' HD11 ' A' ' 18' ' ' ILE . 76.0 m80 66.89 -11.37 0.26 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.696 -0.683 . . . . 1.08 112.664 178.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.4 p -149.03 171.89 15.64 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.214 -0.594 . . . . 1.78 112.592 -170.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.485 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 169.77 -160.31 33.32 Favored Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 115.041 -0.981 . . . . 0.16 110.744 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.36 132.01 52.9 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 117.423 0.612 . . . . 1.04 110.315 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.528 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -143.82 147.43 34.1 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.566 -0.288 . . . . 1.02 111.709 -176.445 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.768 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 64.6 mt -104.44 133.59 48.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.874 0.369 . . . . 1.17 110.178 175.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -132.85 129.14 38.07 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 108.534 -0.913 . . . . 0.43 108.534 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 56.75 34.27 24.35 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.559 0.344 . . . . 0.8 110.977 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm 69.72 -3.98 1.54 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.27 0.841 . . . . 2.57 113.27 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.2 p -92.2 118.03 36.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 108.664 -0.865 . . . . 1.1 108.664 170.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -75.06 145.79 42.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.02 -0.536 . . . . 1.5 110.337 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -160.71 -160.99 11.07 Favored Glycine 0 N--CA 1.439 -1.161 0 C-N-CA 120.149 -1.024 . . . . 0.12 113.244 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -124.66 132.38 71.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 109.281 -0.637 . . . . 1.02 109.281 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.44 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.49 135.39 41.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 110.221 -0.288 . . . . 1.05 110.221 -175.327 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.6 130.42 27.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.625 -0.261 . . . . 1.04 111.499 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.448 HD13 ' HB ' ' A' ' 103' ' ' THR . 43.3 mt -85.55 137.48 20.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.384 0.611 . . . . 1.04 110.449 176.34 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -106.76 106.23 16.65 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.999 -1.0 . . . . 1.98 110.791 -176.014 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -118.86 169.05 10.2 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.502 -0.555 . . . . 1.2 109.502 175.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.7 t70 76.25 -0.73 3.05 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 122.381 1.086 . . . . 0.58 109.601 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.62 HG21 ' O ' ' A' ' 23' ' ' SER . 33.9 m -103.55 -171.65 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 113.7 -1.591 . . . . 1.05 109.869 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.62 ' O ' HG21 ' A' ' 22' ' ' VAL . 54.9 p -71.94 168.34 23.61 Favored Pre-proline 0 C--N 1.318 -0.775 0 N-CA-C 105.259 -2.126 . . . . 1.77 105.259 175.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -42.73 128.29 4.94 Favored 'Trans proline' 0 C--N 1.355 0.92 0 CA-C-N 121.524 1.58 . . . . 0.19 112.059 -145.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.45 ' HB2' ' CG2' ' A' ' 107' ' ' ILE . . . -52.85 142.86 18.05 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-N 114.093 -1.412 . . . . 1.03 112.245 -162.039 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -127.47 168.48 14.84 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 114.534 -1.212 . . . . 0.32 112.133 -168.195 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.512 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.1 tm? -118.16 106.77 13.18 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.649 -1.241 . . . . 1.02 107.649 173.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.448 HG22 ' OG1' ' A' ' 39' ' ' THR . 6.9 m -102.96 107.2 17.92 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 120.998 0.428 . . . . 1.02 111.23 -176.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -85.02 131.39 34.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.716 -0.846 . . . . 0.17 108.716 171.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.419 ' HG2' HG22 ' A' ' 37' ' ' VAL . 60.8 mtt85 -126.43 158.83 34.98 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.918 -0.771 . . . . 2.24 108.918 174.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.0 p -68.15 176.33 2.76 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.669 -0.493 . . . . 0.63 109.669 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.5 p -58.78 -35.96 73.65 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 120.524 -0.471 . . . . 0.96 111.538 -179.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -93.77 -28.74 15.74 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.301 -0.629 . . . . 2.12 109.301 172.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.2 17.41 22.52 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.313 -0.858 . . . . 0.23 113.198 174.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -66.12 -48.26 71.44 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.865 -0.42 . . . . 1.73 109.865 173.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.0 tttt -82.89 138.05 34.02 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.925 -0.768 . . . . 1.91 108.925 174.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.419 HG22 ' HG2' ' A' ' 30' ' ' ARG . 14.5 p -149.25 135.64 12.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.009 0.433 . . . . 1.04 111.157 -177.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -144.58 128.92 17.86 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.881 -0.415 . . . . 0.54 109.881 178.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 47.0 m -117.86 137.96 52.43 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.343 0.497 . . . . 1.04 112.343 -172.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.512 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.68 130.7 55.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 N-CA-C 108.329 -0.989 . . . . 1.04 108.329 169.242 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 94.5 t -93.13 120.43 42.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 O-C-N 121.305 -0.872 . . . . 1.02 108.702 172.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.46 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -67.83 -18.86 64.97 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.875 0.695 . . . . 1.01 112.875 -170.119 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.424 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 15.5 t -69.78 -13.57 62.35 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.327 -0.549 . . . . 1.07 109.84 174.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.2 p -108.99 6.81 25.5 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.934 -0.575 . . . . 1.03 109.844 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.519 HG21 ' CD1' ' A' ' 62' ' ' LEU . 32.2 mm -109.27 138.37 36.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.671 -0.695 . . . . 1.01 109.792 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -102.58 -45.91 4.9 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.805 -0.634 . . . . 0.52 110.631 -178.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.534 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 23.5 mtpp -133.21 173.77 11.09 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.368 0.604 . . . . 1.95 111.861 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.499 ' HG ' ' O ' ' A' ' 47' ' ' LYS . 0.2 OUTLIER -153.38 142.09 20.98 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.809 -1.087 . . . . 1.39 108.657 178.009 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.476 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 15.1 mm-40 -136.53 127.16 27.06 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 110.348 -0.241 . . . . 2.02 110.348 -174.152 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.454 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . . . -121.92 135.2 54.86 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 121.548 -0.72 . . . . 1.05 111.583 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.459 HG21 ' CB ' ' A' ' 57' ' ' LYS . 80.0 p -64.9 119.03 54.71 Favored Pre-proline 0 N--CA 1.467 0.403 0 CA-C-N 115.909 -0.587 . . . . 1.05 110.949 -176.098 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.485 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 23.7 Cg_exo -55.56 159.36 11.15 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.859 2.372 . . . . 0.44 112.006 178.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.67 -14.89 63.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.91 -0.586 . . . . 1.21 110.721 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.58 -7.68 43.38 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.474 -0.785 . . . . 1.94 110.386 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.516 ' C ' ' H ' ' A' ' 57' ' ' LYS . 42.4 m -83.88 147.35 27.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.938 -0.574 . . . . 1.13 111.805 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -70.46 11.94 0.3 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.479 -0.782 . . . . 1.77 111.851 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.539 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 25.8 mmtp -127.03 157.96 38.21 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.58 -0.737 . . . . 2.18 111.41 -171.826 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.559 ' O ' ' HG3' ' A' ' 59' ' ' MET . 70.8 mmm -130.94 96.36 4.04 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.017 -1.105 . . . . 1.11 108.017 165.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.559 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -156.15 152.51 28.0 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.52 0.676 . . . . 1.05 111.891 -172.181 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.491 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.5 tt -131.67 119.62 21.63 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.665 -1.152 . . . . 1.05 108.453 178.094 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.512 ' HG3' ' CE2' ' B' ' 542' ' ' PHE . 7.6 mtp180 -102.24 144.24 31.01 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 121.122 0.487 . . . . 3.5 111.154 -178.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.532 HD21 HD11 ' A' ' 104' ' ' LEU . 1.3 mm? -122.88 111.81 17.1 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.167 -0.924 . . . . 1.03 109.228 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.655 HG13 ' CD ' ' A' ' 86' ' ' ARG . 2.8 mp -87.98 107.76 17.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 122.462 0.305 . . . . 1.11 110.93 -171.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.96 143.75 35.37 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.216 -0.516 . . . . 0.54 112.241 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.431 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.1 mttt -68.85 125.68 27.36 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.221 0.823 . . . . 1.08 113.221 -174.335 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.653 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 2.4 t -120.75 133.42 67.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.368 -0.833 . . . . 2.32 110.182 170.16 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.613 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 24.1 m-20 -94.48 91.63 6.72 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.103 -1.073 . . . . 3.23 108.103 175.49 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.25 -3.8 1.49 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.22 0.822 . . . . 2.39 113.22 -169.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.1 p -71.46 -12.2 61.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.134 0.492 . . . . 3.2 109.959 171.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.613 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 21.1 ptmt -76.4 42.91 0.29 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.693 0.797 . . . . 2.95 110.772 176.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -45.33 115.67 0.97 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.689 -0.687 . . . . 3.72 110.827 -174.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.586 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 79.6 ttt180 -94.65 163.55 13.33 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.605 -0.725 . . . . 4.12 109.39 -172.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 93.7 mttt -130.74 146.19 52.14 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.882 -0.414 . . . . 4.59 109.882 173.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -88.82 -165.66 1.39 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.477 -0.783 . . . . 4.41 110.781 -173.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -66.13 -16.56 64.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.337 0.495 . . . . 5.69 112.337 -176.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.568 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 22.6 mt-10 -107.02 -8.0 16.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.866 0.365 . . . . 5.38 111.088 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.72 14.32 47.2 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.529 -0.844 . . . . 4.47 112.21 -178.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.568 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 50.0 m-80 -71.28 138.9 49.74 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.899 -0.778 . . . . 4.72 108.899 176.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -76.0 100.55 4.93 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.123 0.487 . . . . 4.28 109.811 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.586 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 11.0 m -114.24 106.27 20.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.292 0.567 . . . . 3.51 109.797 -177.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.452 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 t -80.19 128.13 74.3 Favored Pre-proline 0 C--N 1.316 -0.871 0 C-N-CA 120.307 -0.557 . . . . 2.87 110.497 -175.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 25.4 Cg_exo -69.39 138.45 39.04 Favored 'Trans proline' 0 CA--C 1.513 -0.563 0 C-N-CA 123.254 2.636 . . . . 2.06 112.099 -178.378 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm -94.23 146.04 30.86 Favored Pre-proline 0 N--CA 1.427 -1.59 0 CA-C-N 115.2 -0.909 . . . . 3.13 109.331 175.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.653 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 51.6 Cg_exo -50.46 152.24 9.02 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 122.419 2.079 . . . . 0.99 112.13 178.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -75.18 162.75 28.21 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.091 -0.959 . . . . 2.11 108.581 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.655 ' CD ' HG13 ' A' ' 63' ' ' ILE . 0.7 OUTLIER -154.5 116.77 4.28 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 122.025 0.917 . . . . 3.17 111.16 -176.408 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.506 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 87.3 m-70 -94.69 154.52 17.28 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.695 -1.593 . . . . 0.72 107.964 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.406 ' HG3' ' HG2' ' A' ' 61' ' ' ARG . 28.0 ttm -141.22 135.47 30.76 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 118.627 0.649 . . . . 1.07 110.611 174.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 59' ' ' MET . 11.3 m-85 -126.34 134.74 51.0 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.044 -0.526 . . . . 0.27 109.724 174.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.768 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -80.83 158.47 25.38 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.32 -0.622 . . . . 1.68 109.32 176.65 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.491 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.7 m-85 -140.16 171.25 14.43 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.896 0.379 . . . . 0.32 110.99 -178.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -121.94 -15.04 7.93 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.12 -0.491 . . . . 2.7 110.288 175.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 41.6 m-80 -135.86 122.16 20.48 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.238 0.542 . . . . 1.16 110.68 -177.511 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.499 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.8 mmm180 -59.86 -34.8 73.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.098 -0.956 . . . . 3.7 112.276 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.424 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 19.2 m -61.96 -32.67 73.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.854 0.359 . . . . 1.13 110.567 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.622 ' O ' HG12 ' A' ' 100' ' ' ILE . 18.8 t -69.92 -58.8 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 CA-C-N 116.249 -0.432 . . . . 1.06 110.363 179.047 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.541 ' HE3' ' CE ' ' A' ' 58' ' ' MET . 11.6 ptp -55.84 -37.76 69.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.088 -0.505 . . . . 1.02 111.261 -176.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.435 ' N ' ' HG3' ' A' ' 97' ' ' MET . 37.4 t70 -64.65 -48.23 75.57 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.628 -0.429 . . . . 0.34 110.096 176.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 95' ' ' THR . 7.9 t-20 -63.42 -41.68 98.7 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.608 0.763 . . . . 1.58 111.409 -179.274 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.9 mm -63.97 -58.51 7.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 109.278 -0.638 . . . . 1.01 109.278 178.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.454 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 23.5 ttpp -51.44 -47.86 62.92 Favored 'General case' 0 C--O 1.215 -0.729 0 O-C-N 123.785 0.678 . . . . 1.47 110.02 177.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.491 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.9 ttp -48.65 -54.38 14.93 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.238 -0.892 . . . . 1.02 111.255 176.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.726 ' O ' HG13 ' A' ' 107' ' ' ILE . 28.1 m -60.69 -55.2 36.11 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.835 -0.621 . . . . 1.04 110.205 178.608 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 30.7 mt -45.8 -55.03 7.09 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.391 -0.822 . . . . 1.04 110.613 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.402 ' HG2' ' CD1' ' A' ' 48' ' ' LEU . 49.8 mt-30 -53.36 -45.02 69.01 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.519 -1.219 . . . . 1.96 112.454 178.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 102' ' ' MET . 75.5 mm-40 -64.87 -34.96 79.63 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.674 0.75 . . . . 3.11 109.85 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.726 HG13 ' O ' ' A' ' 103' ' ' THR . 8.9 mt -71.45 -45.49 68.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.604 -1.18 . . . . 1.03 110.879 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.511 HG13 ' O ' ' A' ' 104' ' ' LEU . 10.1 mt -63.09 -40.48 89.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.135 -0.484 . . . . 1.04 111.331 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 t -58.18 -26.5 62.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.196 -0.456 . . . . 1.67 111.068 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -63.41 -49.11 75.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.062 0.458 . . . . 1.99 109.883 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.424 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 34.2 m-85 -79.75 -12.16 59.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.619 -0.718 . . . . 1.0 110.013 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -74.83 -41.17 60.42 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.102 -0.954 . . . . 1.46 108.819 174.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -77.85 -39.67 42.73 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-N 115.465 -0.788 . . . . 2.27 110.318 175.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -95.66 42.27 1.09 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.182 -0.917 . . . . 1.47 110.981 -176.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 C--O 1.251 1.163 0 CA-C-N 115.918 -0.583 . . . . 2.72 110.399 -177.527 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.806 0 N-CA-C 111.909 -0.477 . . . . 20.26 111.909 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 19.5 t -74.0 136.33 76.5 Favored Pre-proline 0 C--N 1.327 -0.409 0 N-CA-C 110.143 -0.317 . . . . 18.54 110.143 -179.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -77.43 56.79 5.67 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.839 2.359 . . . . 17.79 112.504 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -101.75 58.85 0.62 Allowed Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.93 -0.652 . . . . 16.44 112.09 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 30.2 p90 -97.35 118.81 64.07 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 121.053 0.454 . . . . 16.12 110.566 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -91.17 16.83 1.5 Allowed 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.921 2.414 . . . . 13.81 112.267 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -77.92 100.17 6.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.825 -0.625 . . . . 12.88 110.168 -178.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 141.73 -112.18 0.74 Allowed Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 115.702 -0.681 . . . . 9.73 111.424 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . 0.494 ' HG ' ' HA3' ' B' ' 530' ' ' GLY . 0.1 OUTLIER -149.17 137.52 20.87 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.601 -0.518 . . . . 8.74 109.601 177.339 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 5.2 tt -111.3 108.6 18.27 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 108.878 -0.786 . . . . 10.79 108.878 172.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 7.6 t 71.46 48.26 0.34 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.991 -1.004 . . . . 7.62 109.103 -177.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . 0.494 ' HA3' ' HG ' ' B' ' 527' ' ' LEU . . . -129.62 -104.6 1.11 Allowed Glycine 0 N--CA 1.436 -1.359 0 CA-C-N 114.96 -1.018 . . . . 5.26 111.309 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -140.6 9.91 2.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.88 0.371 . . . . 5.5 110.511 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -123.03 15.25 9.93 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 121.651 0.738 . . . . 5.68 110.96 -176.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -83.65 -61.97 1.7 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.9 -1.045 . . . . 3.22 111.935 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -92.77 -34.62 13.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.2 0.524 . . . . 5.14 110.985 -175.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 535' ' ' SER . . . . . 0.457 ' O ' ' HB2' ' B' ' 539' ' ' ASP . 0.5 OUTLIER -75.78 -6.08 48.93 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.33 -0.85 . . . . 1.34 112.047 -173.873 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 49.6 m -88.51 -37.66 15.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.083 0.468 . . . . 2.43 110.29 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 46.0 mm -78.49 -33.9 17.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.378 0.609 . . . . 1.69 109.359 174.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -80.84 8.5 8.08 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 121.747 0.784 . . . . 1.36 110.262 173.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.457 ' HB2' ' O ' ' B' ' 535' ' ' SER . 37.7 t70 -92.49 -43.32 9.24 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.082 -1.081 . . . . 1.23 108.082 170.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 61.3 mmm -54.49 -37.43 65.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.454 -1.248 . . . . 2.83 109.407 168.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . 0.424 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 36.9 t70 -53.26 -57.17 11.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 114.799 -1.091 . . . . 1.18 110.793 174.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.512 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.3 OUTLIER -65.62 -39.35 91.4 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.037 -0.983 . . . . 0.66 111.622 -172.412 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 33.5 t -60.24 -38.16 82.57 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.264 -0.426 . . . . 2.08 110.788 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -72.68 -31.69 65.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.098 0.475 . . . . 1.34 110.904 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 94.4 mt -68.95 -44.44 73.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.716 -0.675 . . . . 1.82 111.563 -178.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 44.7 mt -70.69 -26.3 63.36 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.597 0.713 . . . . 1.54 109.462 176.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 8.4 t -70.37 -13.91 62.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.012 -0.995 . . . . 1.92 110.303 176.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -72.51 -20.48 61.35 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.468 0.652 . . . . 3.31 110.107 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 67.8 mt -100.18 -49.67 11.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 115.091 -0.959 . . . . 5.68 109.791 177.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 32.8 m -138.07 107.38 6.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.535 -0.757 . . . . 6.4 110.234 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 44.3 m . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.403 -0.808 . . . . 7.59 110.127 178.028 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo . . . . . 0 N--CA 1.479 0.638 0 N-CA-C 110.556 -0.594 . . . . 2.47 110.556 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.8 p -77.84 105.02 8.75 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 121.096 0.474 . . . . 2.05 109.933 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.466 ' HB3' ' HB ' ' A' ' 18' ' ' ILE . 75.6 m80 -83.51 6.71 19.44 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.722 -0.672 . . . . 1.08 110.448 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.8 t -152.17 155.02 36.99 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.891 -0.724 . . . . 1.78 112.626 -168.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.531 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . -174.44 -164.31 29.15 Favored Glycine 0 N--CA 1.437 -1.245 0 CA-C-N 114.341 -1.3 . . . . 0.16 110.554 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.98 135.05 39.54 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 117.558 0.679 . . . . 1.04 110.906 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.469 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -148.76 153.26 37.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.389 -0.369 . . . . 1.02 111.647 -178.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.743 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.9 mt -112.25 128.29 68.96 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 CA-C-O 120.686 0.279 . . . . 1.17 110.461 177.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -126.97 133.53 50.56 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 108.897 -0.779 . . . . 0.43 108.897 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 58.85 27.77 16.58 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.758 0.423 . . . . 0.8 110.857 -178.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt 70.5 0.06 3.1 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.218 0.607 . . . . 2.57 112.555 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.3 p -92.7 122.46 44.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 108.545 -0.909 . . . . 1.1 108.545 167.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.9 p -81.71 145.98 30.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.224 -0.444 . . . . 1.5 111.072 -173.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.434 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -162.68 -154.92 7.8 Favored Glycine 0 N--CA 1.439 -1.103 0 C-N-CA 120.375 -0.917 . . . . 0.12 113.461 -177.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.9 mm -126.71 130.5 71.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 109.334 -0.617 . . . . 1.02 109.334 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.447 HD12 HD13 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -100.8 137.07 29.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 110.101 -0.333 . . . . 1.05 110.101 -175.857 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.83 129.8 28.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.701 0.286 . . . . 1.04 111.573 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.466 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 41.3 mt -85.5 139.02 18.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.237 0.542 . . . . 1.04 109.81 174.882 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.441 ' O ' ' HA ' ' A' ' 25' ' ' ALA . 17.4 t30 -110.33 103.26 11.9 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.973 -1.012 . . . . 1.98 111.301 -174.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.443 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 31.1 mt-10 -114.61 169.76 8.82 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.863 -0.791 . . . . 1.2 108.863 174.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.443 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 38.0 t70 79.49 -5.59 1.91 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 122.446 1.117 . . . . 0.58 109.776 -176.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.635 HG21 ' O ' ' A' ' 23' ' ' SER . 22.8 m -103.23 -172.73 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.05 0 CA-C-N 113.767 -1.561 . . . . 1.05 109.406 178.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.635 ' O ' HG21 ' A' ' 22' ' ' VAL . 59.3 p -72.41 167.92 28.31 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 105.199 -2.149 . . . . 1.77 105.199 175.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -41.66 127.04 3.35 Favored 'Trans proline' 0 C--N 1.355 0.892 0 CA-C-N 121.317 1.506 . . . . 0.19 112.729 -143.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.441 ' HA ' ' O ' ' A' ' 19' ' ' ASN . . . -43.38 136.8 2.98 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 113.841 -1.527 . . . . 1.03 112.895 -168.705 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.68 169.07 12.33 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 114.092 -1.413 . . . . 0.32 111.679 -169.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.489 ' O ' ' HA ' ' A' ' 39' ' ' THR . 3.2 tm? -119.57 105.38 11.16 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 107.807 -1.183 . . . . 1.02 107.807 174.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.7 m -104.58 106.89 17.56 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-O 121.155 0.502 . . . . 1.02 111.245 -176.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -84.63 128.61 34.69 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.965 -0.754 . . . . 0.17 108.965 172.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.439 ' HG2' HG23 ' A' ' 37' ' ' VAL . 96.1 mtt180 -120.48 158.11 27.94 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.455 -0.943 . . . . 2.24 108.455 172.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 p -70.18 176.09 4.12 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.275 -0.639 . . . . 0.63 109.275 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.434 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 4.2 p -57.32 -36.25 70.88 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.524 . . . . 0.96 111.004 -179.022 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -91.82 -30.92 15.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.569 0.699 . . . . 2.12 109.759 172.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.5 15.5 32.0 Favored Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.152 -0.931 . . . . 0.23 112.769 175.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.92 -42.06 95.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.334 -0.617 . . . . 1.73 109.334 175.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -91.27 139.41 30.76 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.815 -0.809 . . . . 1.91 108.815 173.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.439 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.9 p -149.61 137.72 14.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 120.79 0.328 . . . . 1.04 110.967 -179.071 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -144.51 129.04 18.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.634 -0.257 . . . . 0.54 110.351 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.489 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 53.3 m -112.52 143.59 43.42 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.216 0.451 . . . . 1.04 112.216 -174.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.483 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -113.6 129.89 68.62 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.722 0 N-CA-C 107.923 -1.14 . . . . 1.04 107.923 167.847 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 67.2 t -92.32 121.04 42.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 O-C-N 121.024 -1.047 . . . . 1.02 108.914 173.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.407 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -68.91 -18.38 64.1 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 113.011 0.745 . . . . 1.01 113.011 -169.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 p -69.02 -16.76 63.79 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.574 0.702 . . . . 1.07 109.382 175.184 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.407 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 4.7 p -109.06 16.62 22.43 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.977 -1.011 . . . . 1.03 110.088 -178.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.42 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 31.2 mm -112.25 138.38 41.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.759 -0.46 . . . . 1.01 109.759 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -102.07 -40.22 6.94 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.013 -0.54 . . . . 0.52 110.657 -176.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.444 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 12.4 mtmm -144.96 174.46 11.0 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.872 0.367 . . . . 1.95 111.26 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.5 HD13 ' CG ' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -151.34 133.63 15.32 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.632 -0.877 . . . . 1.39 108.632 177.079 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.498 ' HG3' HD13 ' A' ' 63' ' ' ILE . 9.2 mt-30 -130.01 127.2 39.5 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 110.285 -0.265 . . . . 2.02 110.285 -176.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -118.06 141.47 48.44 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 121.914 -0.492 . . . . 1.05 111.039 178.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.407 HG21 ' HB3' ' A' ' 57' ' ' LYS . 53.0 p -62.29 121.24 65.24 Favored Pre-proline 0 C--N 1.332 -0.175 0 CA-C-N 115.912 -0.585 . . . . 1.05 110.633 -178.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.439 ' O ' ' HB2' ' A' ' 55' ' ' SER . 24.0 Cg_exo -53.96 163.58 3.04 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.66 2.24 . . . . 0.44 112.465 178.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.73 79.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.146 -0.479 . . . . 1.21 110.598 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.0 m -76.11 -13.73 60.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.569 -0.741 . . . . 1.94 111.035 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.439 ' HB2' ' O ' ' A' ' 52' ' ' PRO . 46.1 m -75.1 135.3 41.18 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 121.697 0.761 . . . . 1.13 111.391 179.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -59.46 -26.77 65.51 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.009 -1.45 . . . . 1.77 110.756 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.407 ' HB3' HG21 ' A' ' 51' ' ' THR . 37.0 mmtt -82.74 146.74 28.84 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 114.399 -1.273 . . . . 2.18 111.493 -177.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.591 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.4 OUTLIER -123.07 96.63 5.09 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.032 -0.986 . . . . 1.11 108.564 170.021 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.591 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -156.31 152.31 27.5 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 121.585 0.707 . . . . 1.05 112.069 -173.543 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.55 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.4 tt -129.83 118.89 22.47 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.553 -1.203 . . . . 1.05 108.143 177.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.478 ' HG3' ' CE2' ' B' ' 542' ' ' PHE . 15.0 mtm180 -101.83 133.47 46.54 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.229 0.538 . . . . 3.5 110.886 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.525 HD22 HD11 ' A' ' 104' ' ' LEU . 1.3 mm? -111.84 107.26 16.24 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 115.099 -0.955 . . . . 1.03 109.205 176.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.69 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.4 mp -85.31 97.81 5.88 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 109.368 -0.604 . . . . 1.11 109.368 -172.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -76.31 134.48 15.72 Favored Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 115.941 -0.572 . . . . 0.54 112.46 -176.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.42 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 96.1 mttt -56.65 149.23 18.11 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 123.162 0.585 . . . . 1.08 112.188 -176.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.458 HG13 ' HA ' ' A' ' 84' ' ' PRO . 1.4 m -118.45 146.25 23.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.054 -0.521 . . . . 2.32 110.176 168.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.752 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 18.7 t70 -79.04 81.76 5.28 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.02 -0.733 . . . . 3.23 109.02 176.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.11 -2.3 5.41 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.013 0.745 . . . . 2.39 113.013 -169.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.16 -14.16 62.18 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.155 0.503 . . . . 3.2 110.059 170.105 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.752 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.1 ptpt -82.3 36.22 0.46 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.759 -0.655 . . . . 2.95 110.742 175.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.499 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 31.5 mmtm -44.97 116.1 1.02 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.624 -0.51 . . . . 3.72 109.624 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.606 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 60.4 ttt180 -96.87 164.49 12.53 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 108.755 -0.831 . . . . 4.12 108.755 -173.065 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.527 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 57.3 mttp -127.69 141.88 51.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.987 0.422 . . . . 4.59 110.023 171.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -82.69 -171.07 3.3 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.466 -0.788 . . . . 4.41 110.451 -176.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -61.27 -31.14 70.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 111.606 0.225 . . . . 5.69 111.606 -178.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.461 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 28.1 mt-10 -85.14 -18.81 33.04 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.079 -0.248 . . . . 5.38 111.332 -179.11 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 99.84 25.67 8.97 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.403 -0.903 . . . . 4.47 112.952 177.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.527 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 31.1 m-80 -90.47 144.69 25.56 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.233 -0.654 . . . . 4.72 109.233 176.256 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -69.86 91.45 0.65 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.883 0.373 . . . . 4.28 110.168 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.606 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.7 m -102.68 97.38 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 CA-C-O 122.014 0.911 . . . . 3.51 108.99 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.499 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 2.2 p -83.04 130.82 55.85 Favored Pre-proline 0 C--N 1.31 -1.15 0 CA-C-N 115.313 -0.858 . . . . 2.87 109.784 -178.221 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 47.8 Cg_exo -60.07 132.81 46.5 Favored 'Trans proline' 0 CA--C 1.512 -0.599 0 C-N-CA 122.77 2.313 . . . . 2.06 111.993 -176.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -82.98 154.38 67.42 Favored Pre-proline 0 C--N 1.315 -0.906 0 CA-C-N 115.228 -0.897 . . . . 3.13 109.252 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.458 ' HA ' HG13 ' A' ' 66' ' ' VAL . 21.3 Cg_exo -60.12 149.49 84.55 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.795 2.33 . . . . 0.99 112.153 -174.518 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -89.63 115.63 27.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.359 0.6 . . . . 2.11 110.256 -174.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.476 ' HG2' HG13 ' A' ' 63' ' ' ILE . 47.5 mtm180 -98.85 122.26 41.87 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 115.768 -0.651 . . . . 3.17 111.623 -170.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.456 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 59.3 m-70 -97.02 111.42 23.65 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.092 -0.958 . . . . 0.72 109.361 -178.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 33.5 ttm -107.75 131.95 53.9 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.857 -0.737 . . . . 1.07 111.643 -176.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.518 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.7 m-85 -121.19 133.06 55.17 Favored 'General case' 0 C--O 1.215 -0.714 0 CA-C-N 115.5 -0.773 . . . . 0.27 109.869 177.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.743 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -80.05 159.23 26.24 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.231 -0.655 . . . . 1.68 109.231 176.501 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.55 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 18.7 m-85 -136.85 173.28 11.87 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.377 0.608 . . . . 0.32 112.021 -177.392 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -118.7 -21.46 7.87 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.043 -0.98 . . . . 2.7 110.208 178.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.421 ' HB2' HG21 ' A' ' 96' ' ' VAL . 53.4 m-80 -139.49 125.95 20.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.215 0.531 . . . . 1.16 110.74 -177.921 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.554 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.7 mmm180 -57.89 -30.88 66.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.192 -0.913 . . . . 3.7 111.997 177.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.7 m -64.27 -29.22 70.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.004 0.43 . . . . 1.13 110.554 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.721 ' HA ' ' ND2' ' A' ' 99' ' ' ASN . 5.2 t -85.15 -46.68 17.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 116.233 -0.44 . . . . 1.06 110.983 -177.347 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.554 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 10.2 ptp -61.72 -25.56 67.5 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.171 -0.612 . . . . 1.02 109.668 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.4 ' O ' ' HB2' ' A' ' 102' ' ' MET . 20.8 t70 -77.39 -38.59 49.57 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.137 -0.483 . . . . 0.34 110.642 172.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.721 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 11.2 p30 -77.12 -33.58 56.79 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.705 0.261 . . . . 1.58 111.705 -175.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.536 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 39.2 mm -70.52 -56.02 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.529 0 N-CA-C 108.388 -0.967 . . . . 1.01 108.388 174.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.523 ' HB2' ' O ' ' A' ' 97' ' ' MET . 31.5 ttpt -48.89 -48.51 42.27 Favored 'General case' 0 C--O 1.218 -0.569 0 O-C-N 123.976 0.797 . . . . 1.47 109.752 176.648 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.764 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 40.7 ttp -48.44 -59.62 3.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.49 -0.777 . . . . 1.02 110.757 177.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.721 ' O ' HG13 ' A' ' 107' ' ' ILE . 60.0 m -57.77 -52.89 63.59 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.483 0.489 . . . . 1.04 110.71 -179.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 24.7 mt -47.28 -55.42 8.74 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.486 0.66 . . . . 1.04 110.527 175.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.5 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.3 mt-30 -51.69 -44.21 63.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.615 -1.175 . . . . 1.96 112.074 177.003 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.764 ' HG3' ' O ' ' A' ' 102' ' ' MET . 81.0 mt-30 -64.36 -35.47 80.97 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.725 0.774 . . . . 3.11 109.367 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.721 HG13 ' O ' ' A' ' 103' ' ' THR . 7.6 mt -75.95 -43.35 39.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 114.257 -1.338 . . . . 1.03 111.559 -176.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 104' ' ' LEU . 7.2 mt -62.19 -43.15 97.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.25 0.463 . . . . 1.04 112.25 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.439 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 24.2 t -62.45 -20.17 64.26 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.69 0.281 . . . . 1.67 111.279 -176.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -65.21 -44.21 89.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.518 0.675 . . . . 1.99 109.307 173.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -87.54 -11.78 47.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.088 -0.96 . . . . 1.0 110.303 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.439 ' CB ' ' HA ' ' A' ' 109' ' ' SER . 1.8 tpmt? -70.06 -37.91 75.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.795 -0.817 . . . . 1.46 108.795 173.195 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -67.3 -39.16 85.92 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 115.121 -0.945 . . . . 2.27 109.951 172.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -96.82 42.0 1.1 Allowed 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 114.859 -1.064 . . . . 1.47 110.684 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.6 t70 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.583 -0.723 . . . . 2.72 109.916 -179.119 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.774 0 N-CA-C 112.116 -0.394 . . . . 20.26 112.116 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 50.8 m -150.64 75.09 8.61 Favored Pre-proline 0 C--N 1.322 -0.587 0 N-CA-C 109.88 -0.415 . . . . 18.54 109.88 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -69.14 -21.16 36.79 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 123.278 2.652 . . . . 17.79 112.523 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 81.79 -124.74 6.59 Favored Glycine 0 N--CA 1.442 -0.942 0 N-CA-C 111.154 -0.778 . . . . 16.44 111.154 -176.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 64.75 113.32 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.344 0 CA-C-O 121.235 0.54 . . . . 16.12 112.238 177.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -57.13 150.49 56.68 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.499 2.133 . . . . 13.81 111.253 173.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -78.05 47.14 0.63 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.99 0.367 . . . . 12.88 111.99 -174.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 63.94 -89.71 0.08 OUTLIER Glycine 0 CA--C 1.518 0.264 0 N-CA-C 114.11 0.404 . . . . 9.73 114.11 174.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -80.12 26.45 0.35 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.446 0.535 . . . . 8.74 112.446 -171.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 26.0 mt -66.05 -11.0 45.38 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 121.535 0.683 . . . . 10.79 110.17 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 9.3 m -113.11 -37.26 4.81 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.757 -1.111 . . . . 7.62 108.712 174.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 108.95 -33.24 6.28 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.479 -0.782 . . . . 5.26 113.289 174.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -100.86 -4.17 28.35 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.973 0.892 . . . . 5.5 109.124 -176.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -96.81 -0.56 47.78 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.265 -1.334 . . . . 5.68 110.463 -178.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -73.03 -38.19 66.64 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.402 -1.272 . . . . 3.22 110.907 -176.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -60.8 -47.62 85.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.651 -0.704 . . . . 5.14 110.781 -177.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 11.4 p -77.41 -12.68 59.98 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.198 -0.91 . . . . 1.34 111.357 -177.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 69.2 m -80.69 -39.34 27.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.983 0.421 . . . . 2.43 110.134 174.029 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 13.3 mm -75.15 -42.82 44.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.191 -0.459 . . . . 1.69 110.511 175.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -75.43 4.06 8.06 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.454 0.645 . . . . 1.36 110.923 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -80.3 -37.43 32.71 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.804 -0.813 . . . . 1.23 108.804 170.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 42.1 mtm -63.8 -32.45 73.95 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.017 -0.992 . . . . 2.83 109.349 173.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . 0.569 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 3.3 m-20 -65.19 -56.39 13.1 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.464 -0.789 . . . . 1.18 110.889 173.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.478 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -65.74 -49.01 69.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.566 -0.743 . . . . 0.66 112.454 -171.175 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 31.5 t -60.83 -37.92 83.66 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.843 0.354 . . . . 2.08 110.546 -176.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -68.9 -23.92 64.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.083 -0.508 . . . . 1.34 111.216 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 95.4 mt -80.01 -42.25 24.22 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.355 -0.384 . . . . 1.82 111.461 -178.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 61.0 mt -70.09 -40.77 74.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.49 0.662 . . . . 1.54 110.214 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 39.6 m -86.21 25.61 1.15 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.141 -0.936 . . . . 1.92 112.172 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -128.4 24.05 5.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.984 0.421 . . . . 3.31 110.177 173.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 3.5 tt -69.87 111.79 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 CA-C-O 121.414 0.626 . . . . 5.68 110.53 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 5.2 p -94.43 66.51 3.34 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.545 -0.752 . . . . 6.4 110.03 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 21.7 t . . . . . 0 C--O 1.247 0.964 0 CA-C-N 115.272 -0.876 . . . . 7.59 108.875 -177.846 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo . . . . . 0 N--CA 1.476 0.442 0 N-CA-C 110.778 -0.508 . . . . 2.47 110.778 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 m -73.87 -18.4 60.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.21 -0.45 . . . . 2.05 111.193 -178.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.433 ' HB3' ' HB ' ' A' ' 18' ' ' ILE . 75.9 m80 68.74 2.48 3.49 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.498 0.555 . . . . 1.08 112.498 175.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.2 t -153.03 157.74 40.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.779 0.8 . . . . 1.78 112.717 -169.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.472 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -176.08 -170.04 38.33 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 114.125 -1.398 . . . . 0.16 109.83 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -93.19 135.17 34.64 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 117.71 0.755 . . . . 1.04 110.375 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.412 ' HB2' ' HB3' ' A' ' 89' ' ' PHE . . . -145.85 146.04 30.98 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.275 -0.42 . . . . 1.02 111.367 -177.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.425 HG12 ' HA ' ' A' ' 13' ' ' SER . 85.1 mt -107.37 120.65 59.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.304 -0.407 . . . . 1.17 110.287 177.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -123.36 137.47 54.82 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.801 -0.814 . . . . 0.43 108.801 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 57.27 25.66 11.39 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.659 0.384 . . . . 0.8 110.736 -176.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt 69.14 5.63 5.2 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.774 0.657 . . . . 2.57 112.774 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -97.48 129.9 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 108.884 -0.784 . . . . 1.1 108.884 166.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.425 ' HA ' HG12 ' A' ' 8' ' ' ILE . 15.0 m -78.53 146.07 34.52 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.02 0.438 . . . . 1.5 110.861 -175.234 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.19 -160.18 11.69 Favored Glycine 0 N--CA 1.437 -1.273 0 C-N-CA 120.133 -1.032 . . . . 0.12 113.052 -178.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.6 mm -126.05 133.11 69.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.148 -0.686 . . . . 1.02 109.148 -178.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.421 HD13 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.75 134.91 42.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 109.886 -0.413 . . . . 1.05 109.886 -176.862 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.95 130.61 31.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.568 0.223 . . . . 1.04 111.149 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.433 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 47.3 mt -86.6 139.4 17.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.311 0.577 . . . . 1.04 110.397 175.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -110.38 105.88 15.04 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 114.933 -1.03 . . . . 1.98 111.185 -176.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -116.9 170.41 8.64 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.146 -0.687 . . . . 1.2 109.146 174.692 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t70 77.78 -1.49 2.62 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 122.505 1.145 . . . . 0.58 109.399 -179.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.627 HG22 ' O ' ' A' ' 23' ' ' SER . 31.6 m -103.48 -171.86 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 113.559 -1.655 . . . . 1.05 109.383 177.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.627 ' O ' HG22 ' A' ' 22' ' ' VAL . 70.7 p -72.67 168.65 22.2 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 105.202 -2.148 . . . . 1.77 105.202 174.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -41.53 129.0 3.59 Favored 'Trans proline' 0 C--N 1.357 0.994 0 CA-C-N 121.501 1.572 . . . . 0.19 112.368 -145.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.438 ' HB1' ' CG2' ' A' ' 107' ' ' ILE . . . -52.56 142.17 18.64 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 114.164 -1.38 . . . . 1.03 112.381 -162.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.76 168.68 12.87 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.64 -1.163 . . . . 0.32 112.019 -170.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.511 ' HB3' HG23 ' A' ' 40' ' ' VAL . 3.1 tm? -119.79 108.97 15.04 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.798 -1.186 . . . . 1.02 107.798 175.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m -103.98 107.08 17.81 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 120.761 0.315 . . . . 1.02 111.1 -176.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.417 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 86.9 t90 -86.85 129.04 35.04 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.122 -0.696 . . . . 0.17 109.122 171.365 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.446 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 92.0 mtt180 -123.32 160.55 26.48 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.059 -0.719 . . . . 2.24 109.059 172.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.4 p -70.65 175.72 4.7 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.204 -0.665 . . . . 0.63 109.204 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.0 p -59.32 -35.88 74.62 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.221 -0.592 . . . . 0.96 111.104 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -88.39 -32.56 18.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.579 0.704 . . . . 2.12 109.396 171.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.446 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 98.56 14.79 36.69 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 114.957 -1.019 . . . . 0.23 113.339 173.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -67.47 -40.96 85.31 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.186 0.517 . . . . 1.73 109.776 174.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.2 135.58 33.52 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.577 -0.897 . . . . 1.91 108.577 174.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 12.0 p -149.46 140.26 16.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 C-N-CA 120.846 -0.342 . . . . 1.04 111.461 -177.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -144.32 125.4 14.51 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.832 -0.432 . . . . 0.54 109.832 175.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 41.1 m -109.26 137.63 46.84 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.752 0.279 . . . . 1.04 111.752 -175.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.511 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -107.98 128.84 63.02 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 108.329 -0.989 . . . . 1.04 108.329 169.583 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 79.5 t -92.84 120.02 41.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 O-C-N 121.234 -0.916 . . . . 1.02 108.781 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.45 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.7 mm? -69.08 -19.59 64.07 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.077 0.769 . . . . 1.01 113.077 -169.194 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.6 p -69.46 -14.87 63.12 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 119.821 -0.752 . . . . 1.07 109.553 175.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.6 p -109.93 11.34 24.16 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.477 -0.783 . . . . 1.03 109.921 -179.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.508 HG23 ' CD1' ' A' ' 62' ' ' LEU . 20.5 mm -111.84 139.88 34.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.718 -0.674 . . . . 1.01 109.263 178.028 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -108.44 -40.73 5.04 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.396 -0.365 . . . . 0.52 110.914 -176.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.52 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 34.6 mtpt -132.61 167.83 19.34 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.709 0.766 . . . . 1.95 111.402 -178.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.485 HD11 ' HG2' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -150.77 132.69 15.12 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.432 -1.258 . . . . 1.39 107.862 174.811 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.459 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -133.06 114.76 14.3 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.329 -0.249 . . . . 2.02 110.329 -172.413 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.429 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . . . -110.09 145.16 37.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.827 0.346 . . . . 1.05 110.981 -178.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.406 HG23 ' HB3' ' A' ' 57' ' ' LYS . 76.4 p -67.54 118.42 56.91 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.765 -0.652 . . . . 1.05 110.781 -177.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.556 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 9.6 Cg_exo -59.82 163.16 14.12 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.445 2.097 . . . . 0.44 111.737 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.96 -8.05 53.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.199 -0.455 . . . . 1.21 111.032 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.4 t -94.22 -4.82 48.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.358 0.599 . . . . 1.94 109.676 174.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.556 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 33.9 m -87.65 143.23 27.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.601 -0.727 . . . . 1.13 111.175 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -69.24 -12.07 61.35 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.031 -0.986 . . . . 1.77 110.615 175.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.448 ' HG2' ' HE1' ' A' ' 59' ' ' MET . 1.4 mptp? -99.86 154.06 18.65 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 114.894 -1.048 . . . . 2.18 111.391 -174.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.432 ' HE3' ' HE2' ' A' ' 97' ' ' MET . 80.5 mmm -127.67 98.25 5.13 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.109 -0.7 . . . . 1.11 109.109 168.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.468 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.2 OUTLIER -156.36 155.59 32.45 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.869 -0.605 . . . . 1.05 111.644 -173.205 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.441 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.5 tt -130.81 119.15 21.84 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.363 -0.977 . . . . 1.05 108.363 175.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.535 ' NH1' ' HD2' ' A' ' 86' ' ' ARG . 52.2 mtm180 -101.24 146.32 27.69 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.877 0.37 . . . . 3.5 111.288 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.515 HD21 HD12 ' A' ' 104' ' ' LEU . 1.2 mm? -128.15 106.75 9.27 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.399 -0.819 . . . . 1.03 109.565 179.563 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.568 ' N ' HD13 ' A' ' 63' ' ' ILE . 2.6 mp -95.71 113.97 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 122.509 0.323 . . . . 1.11 110.478 -172.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.641 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -65.25 169.22 28.57 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 121.26 -0.495 . . . . 0.54 113.194 178.909 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -86.31 150.9 24.02 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.871 0.367 . . . . 1.08 110.926 177.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.474 HG21 ' HG3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -106.29 118.86 54.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 115.952 -0.567 . . . . 2.32 111.617 -174.915 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.765 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.1 t70 -92.35 77.4 5.15 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.119 -1.067 . . . . 3.23 108.119 170.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.41 ' HG3' ' HB ' ' A' ' 66' ' ' VAL . 43.3 mt-10 -73.16 -2.24 20.79 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.847 0.314 . . . . 2.39 111.847 -170.037 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.8 p -71.53 -6.3 39.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.36 0.6 . . . . 3.2 110.166 171.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.765 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 17.8 ptmt -91.35 36.17 0.93 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.677 -0.692 . . . . 2.95 110.402 175.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.525 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 13.1 mmmt -44.33 113.93 0.61 Allowed 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.132 -0.692 . . . . 3.72 109.132 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.592 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.0 ttt180 -102.4 167.02 10.22 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.621 -0.718 . . . . 4.12 109.303 -168.246 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.488 ' N ' ' HG2' ' A' ' 72' ' ' ARG . 56.5 mttp -132.6 128.46 37.2 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.642 -0.503 . . . . 4.59 109.642 171.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -83.3 -166.06 1.26 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.026 -0.534 . . . . 4.41 110.021 -178.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -58.79 -26.16 63.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.913 0.387 . . . . 5.69 111.554 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -87.27 -7.44 57.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.937 -0.574 . . . . 5.38 111.782 -174.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.57 3.65 88.97 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.736 -0.745 . . . . 4.47 112.347 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.411 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 93.9 m-20 -71.19 139.64 50.23 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.438 -0.579 . . . . 4.72 109.438 175.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.496 ' CD ' ' HE3' ' A' ' 71' ' ' LYS . 34.3 tt0 -72.1 90.39 1.19 Allowed 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.529 -0.545 . . . . 4.28 109.529 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.592 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 31.3 m -92.68 99.51 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.168 0 CA-C-O 121.785 0.803 . . . . 3.51 109.208 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.525 ' HB ' ' HD2' ' A' ' 71' ' ' LYS . 0.8 OUTLIER -80.03 108.38 9.14 Favored Pre-proline 0 C--N 1.309 -1.165 0 N-CA-C 108.813 -0.81 . . . . 2.87 108.813 175.951 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -58.23 138.8 87.83 Favored 'Trans proline' 0 CA--C 1.513 -0.527 0 C-N-CA 123.363 2.709 . . . . 2.06 112.953 -170.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.409 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 21.9 mtpp -82.61 164.73 45.82 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 114.972 -1.013 . . . . 3.13 109.66 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.641 ' HB3' ' O ' ' A' ' 64' ' ' GLY . 17.6 Cg_exo -58.81 155.73 36.46 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.104 1.87 . . . . 0.99 112.366 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -85.48 113.97 22.15 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 108.679 -0.86 . . . . 2.11 108.679 174.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.535 ' HD2' ' NH1' ' A' ' 61' ' ' ARG . 29.8 ttp180 -111.5 117.24 32.47 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 114.837 -1.074 . . . . 3.17 110.553 -170.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 78.3 m-70 -95.85 148.98 22.03 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 113.749 -1.568 . . . . 0.72 108.69 -175.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.434 ' SD ' ' HE2' ' A' ' 59' ' ' MET . 32.6 ttm -141.34 129.46 22.1 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.396 -0.522 . . . . 1.07 110.838 173.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.412 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 8.7 m-85 -118.19 127.42 53.73 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.611 -0.722 . . . . 0.27 109.565 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.468 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -80.69 153.55 27.82 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 109.825 -0.435 . . . . 1.68 109.825 177.205 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.441 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 22.1 m-85 -133.58 170.3 15.72 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.247 0.546 . . . . 0.32 111.543 -174.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -117.51 -13.86 10.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.245 -0.889 . . . . 2.7 109.927 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.443 ' HB2' HG23 ' A' ' 96' ' ' VAL . 57.1 m-80 -141.31 126.17 18.13 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.038 0.447 . . . . 1.16 110.432 -177.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.453 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.5 mmm180 -62.33 -34.13 76.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.413 -0.812 . . . . 3.7 111.816 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.7 m -63.05 -32.67 74.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.404 -0.362 . . . . 1.13 110.793 -177.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.538 ' O ' HG12 ' A' ' 100' ' ' ILE . 11.8 t -71.04 -57.45 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 116.206 -0.452 . . . . 1.06 110.284 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.453 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.6 ptp -56.53 -39.07 72.73 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.974 -0.557 . . . . 1.02 111.136 -176.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.426 ' N ' ' HG3' ' A' ' 97' ' ' MET . 16.0 t70 -65.13 -39.44 93.04 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.804 -0.358 . . . . 0.34 110.36 179.042 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -75.08 -39.9 60.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.247 -0.433 . . . . 1.58 111.763 -179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.2 mm -63.89 -55.52 21.84 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.361 0 N-CA-C 108.656 -0.868 . . . . 1.01 108.656 176.007 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.48 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 31.4 ttpt -51.05 -47.51 61.75 Favored 'General case' 0 C--O 1.218 -0.565 0 O-C-N 123.827 0.704 . . . . 1.47 109.885 176.662 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.675 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 35.2 ttp -50.33 -56.3 11.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.626 -0.715 . . . . 1.02 110.999 177.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.7 ' O ' HG13 ' A' ' 107' ' ' ILE . 40.5 m -58.32 -53.29 59.99 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.482 0.489 . . . . 1.04 110.557 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 25.8 mt -47.23 -54.38 10.95 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.722 -0.672 . . . . 1.04 110.631 175.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.485 ' HG2' HD11 ' A' ' 48' ' ' LEU . 44.1 mt-30 -51.25 -46.63 62.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.698 -1.137 . . . . 1.96 112.223 177.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' A' ' 102' ' ' MET . 18.9 mt-30 -60.04 -40.46 89.49 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-O 122.006 0.908 . . . . 3.11 108.864 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.7 HG13 ' O ' ' A' ' 103' ' ' THR . 7.4 mt -69.15 -46.5 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 CA-C-N 113.878 -1.51 . . . . 1.03 111.165 -178.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.475 HD12 HD13 ' A' ' 48' ' ' LEU . 6.0 mt -62.24 -42.19 94.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.223 -0.444 . . . . 1.04 111.635 -177.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.9 t -56.88 -29.69 63.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.655 0.264 . . . . 1.67 111.022 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -61.1 -42.11 97.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.459 0.647 . . . . 1.99 109.905 176.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -92.43 -3.93 54.49 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.217 -0.901 . . . . 1.0 110.22 -178.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.79 -37.1 23.01 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.316 -0.856 . . . . 1.46 108.884 176.629 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -81.28 -12.05 59.19 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.271 -0.877 . . . . 2.27 110.702 174.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -89.71 29.31 1.18 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.888 -0.596 . . . . 1.47 110.773 178.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.4 t70 . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.472 -0.775 . . . . 2.72 110.37 -179.839 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.589 0 N-CA-C 111.877 -0.489 . . . . 20.26 111.877 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 16.4 m 60.13 85.44 0.18 Allowed Pre-proline 0 CA--C 1.533 0.317 0 C-N-CA 122.741 0.416 . . . . 18.54 110.954 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.84 113.39 1.97 Allowed 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.673 2.248 . . . . 17.79 112.604 -176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -78.37 -31.6 45.8 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.82 -0.627 . . . . 16.44 111.779 178.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . 0.42 ' HA ' ' HD3' ' B' ' 524' ' ' PRO . 43.8 p90 -140.3 138.65 19.36 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.64 -0.504 . . . . 16.12 109.64 177.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' B' ' 523' ' ' TYR . 33.1 Cg_exo -61.5 108.89 0.66 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.622 2.215 . . . . 13.81 111.967 178.379 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -118.72 -90.51 0.57 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.342 -0.39 . . . . 12.88 110.485 -179.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 61.56 -163.48 22.96 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 121.025 -0.607 . . . . 9.73 112.451 -178.325 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 2.1 pp -87.67 8.4 25.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.715 0.769 . . . . 8.74 110.58 176.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 1.2 tt -80.14 -0.26 35.2 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 106.993 -1.484 . . . . 10.79 106.993 169.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 50.7 m -138.08 173.31 11.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 113.897 -1.501 . . . . 7.62 108.332 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 140.87 -36.4 1.76 Allowed Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.11 -1.043 . . . . 5.26 112.071 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -150.83 -41.22 0.12 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.535 0.684 . . . . 5.5 111.362 -179.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -81.32 -7.55 59.59 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.268 -0.878 . . . . 5.68 111.745 -175.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -97.13 -9.27 28.27 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.894 -1.048 . . . . 3.22 111.515 -175.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -57.75 -48.9 78.33 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.183 0.516 . . . . 5.14 111.482 -178.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 11.2 p -70.26 -27.47 64.46 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.598 -0.728 . . . . 1.34 111.094 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 11.7 m -74.72 -39.49 61.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.162 -0.472 . . . . 2.43 110.723 178.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 18.5 mm -74.8 -28.03 21.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.101 -0.5 . . . . 1.69 110.326 175.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . 0.427 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -71.81 -1.17 13.16 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.466 0.65 . . . . 1.36 111.459 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -73.06 -38.52 66.44 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.746 -0.835 . . . . 1.23 108.746 170.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 85.7 mtp -65.71 -35.28 80.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.028 -0.987 . . . . 2.83 109.857 175.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . 0.524 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 0.2 OUTLIER -65.27 -49.16 70.62 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.759 -0.655 . . . . 1.18 110.495 177.159 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.407 ' HA ' HD12 ' B' ' 545' ' ' LEU . 0.2 OUTLIER -68.32 -31.66 71.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.225 -0.898 . . . . 0.66 111.289 -173.382 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 5.9 t -61.28 -36.79 81.0 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.034 0.445 . . . . 2.08 109.891 179.129 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -76.0 -28.64 57.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.77 -0.65 . . . . 1.34 110.961 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . 0.524 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 94.6 mt -70.04 -41.42 74.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.928 -0.578 . . . . 1.82 111.697 -177.574 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 59.1 mt -75.44 -24.93 57.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.348 0.594 . . . . 1.54 109.791 178.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 55.7 m -93.28 27.45 2.53 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.15 -0.932 . . . . 1.92 111.535 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -74.38 -17.2 60.84 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.476 0.655 . . . . 3.31 109.579 172.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 24.2 mm -94.99 66.69 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 115.239 -0.892 . . . . 5.68 109.135 176.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 20.2 t -140.6 81.72 1.82 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.509 -0.769 . . . . 6.4 109.768 -177.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 5.6 p . . . . . 0 C--O 1.245 0.866 0 CA-C-O 118.34 -0.838 . . . . 7.59 110.091 179.969 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo . . . . . 0 N--CA 1.478 0.578 0 N-CA-C 110.238 -0.716 . . . . 2.47 110.238 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.1 m -153.57 114.67 4.12 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.932 0.396 . . . . 2.05 110.241 179.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.429 ' HA ' HD11 ' A' ' 18' ' ' ILE . 25.1 m80 -92.17 8.18 39.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.96 -0.564 . . . . 1.08 110.071 175.389 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 56.9 p -157.24 168.47 27.32 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.184 -0.607 . . . . 1.78 111.997 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.437 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 175.83 -169.11 41.72 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.108 -0.951 . . . . 0.16 110.814 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -98.07 129.07 44.92 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 117.237 0.519 . . . . 1.04 110.164 177.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.47 145.68 32.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.866 0.365 . . . . 1.02 111.477 -176.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.423 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 83.1 mt -102.89 129.95 53.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 116.332 -0.394 . . . . 1.17 110.091 176.21 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.472 ' O ' HG13 ' A' ' 12' ' ' VAL . 26.0 t80 -141.85 141.02 33.07 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 108.871 -0.788 . . . . 0.43 108.871 178.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 62.48 24.99 14.9 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.826 -0.435 . . . . 0.8 109.826 -176.732 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt 64.61 1.72 1.43 Allowed 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 113.54 0.941 . . . . 2.57 113.54 -177.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.472 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -95.79 125.51 48.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 108.722 -0.844 . . . . 1.1 108.722 169.633 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.408 ' HA ' HG12 ' A' ' 8' ' ' ILE . 59.4 p -75.6 145.13 41.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.799 0.333 . . . . 1.5 110.483 -176.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.445 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -160.82 -160.28 10.57 Favored Glycine 0 N--CA 1.438 -1.169 0 C-N-CA 119.742 -1.218 . . . . 0.12 113.926 -175.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.3 mm -125.71 131.76 71.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 N-CA-C 108.935 -0.765 . . . . 1.02 108.935 -179.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.439 ' CD1' HD13 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.33 136.98 33.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 110.272 -0.27 . . . . 1.05 110.272 -176.357 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.72 130.1 31.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.911 0.386 . . . . 1.04 111.486 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.476 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 54.7 mt -86.43 135.25 25.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 109.918 -0.401 . . . . 1.04 109.918 177.768 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.0 101.06 10.17 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.156 -0.475 . . . . 1.98 110.694 -176.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -114.42 169.73 8.83 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.431 -0.581 . . . . 1.2 109.431 176.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t70 76.01 -1.56 2.93 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.966 0.888 . . . . 0.58 109.96 -177.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.593 HG21 ' O ' ' A' ' 23' ' ' SER . 31.6 m -102.62 -174.87 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 114.472 -1.24 . . . . 1.05 109.928 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.593 ' O ' HG21 ' A' ' 22' ' ' VAL . 58.3 m -73.84 164.03 64.08 Favored Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 105.045 -2.206 . . . . 1.77 105.045 174.05 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -41.18 127.73 2.94 Favored 'Trans proline' 0 C--N 1.352 0.73 0 CA-C-N 121.15 1.446 . . . . 0.19 112.629 -137.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.623 ' H ' ' HH ' ' A' ' 111' ' ' TYR . . . -51.49 141.27 16.16 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 113.713 -1.585 . . . . 1.03 112.164 -165.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -125.43 166.76 16.01 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 114.37 -1.286 . . . . 0.32 111.844 -170.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.5 ' HB3' HG23 ' A' ' 40' ' ' VAL . 3.3 tm? -115.53 105.03 12.33 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 107.422 -1.325 . . . . 1.02 107.422 173.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.8 m -99.03 106.9 19.2 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 120.933 0.397 . . . . 1.02 111.056 -176.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -84.48 132.56 34.53 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.907 -0.775 . . . . 0.17 108.907 171.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.449 ' HG2' HG23 ' A' ' 37' ' ' VAL . 66.6 mtt180 -124.6 159.09 31.51 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 108.463 -0.94 . . . . 2.24 108.463 174.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.0 p -71.96 177.57 4.23 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.987 -0.746 . . . . 0.63 108.987 177.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.445 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.2 p -60.19 -33.84 72.79 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.969 -0.692 . . . . 0.96 110.898 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -87.73 -31.63 19.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.76 0.79 . . . . 2.12 109.394 171.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.432 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 93.02 11.02 59.22 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 114.51 -1.223 . . . . 0.23 112.29 177.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -60.58 -45.23 94.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.343 -0.614 . . . . 1.73 109.343 173.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.5 tttm -83.52 138.68 33.31 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.652 -0.87 . . . . 1.91 108.652 172.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.449 HG23 ' HG2' ' A' ' 30' ' ' ARG . 9.8 p -143.81 139.88 25.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 120.849 0.356 . . . . 1.04 110.552 -178.456 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -145.09 115.19 7.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.578 -0.283 . . . . 0.54 110.321 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 50.8 m -108.19 133.74 52.03 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.607 0.595 . . . . 1.04 112.607 -174.609 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.5 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.35 130.17 52.66 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.587 0 N-CA-C 108.082 -1.081 . . . . 1.04 108.082 168.989 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.404 ' O ' HG12 ' A' ' 45' ' ' ILE . 74.5 t -93.01 120.68 42.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 O-C-N 121.193 -0.942 . . . . 1.02 109.199 173.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -68.73 -20.5 64.39 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.916 0.71 . . . . 1.01 112.916 -170.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.5 p -67.49 -18.1 64.93 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.948 -0.76 . . . . 1.07 108.948 176.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.405 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 5.3 p -109.03 14.1 24.22 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.142 -0.936 . . . . 1.03 110.07 -177.632 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.463 ' HA ' ' HA2' ' A' ' 64' ' ' GLY . 24.7 mm -110.06 138.76 36.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.168 -0.679 . . . . 1.01 109.168 177.279 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.443 ' HB2' ' HG2' ' A' ' 65' ' ' LYS . 37.2 t70 -101.84 -41.58 6.46 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.278 -0.419 . . . . 0.52 110.487 -176.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.411 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 13.1 mtmt -144.51 175.75 9.9 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.983 0.42 . . . . 1.95 111.255 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.446 ' CD2' ' HB3' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -151.81 140.35 20.65 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.704 -0.85 . . . . 1.39 108.704 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -139.72 115.89 10.44 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.047 0.385 . . . . 2.02 111.734 -173.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.467 ' HB3' ' HD3' ' A' ' 101' ' ' LYS . . . -111.26 144.84 39.78 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.73 0.3 . . . . 1.05 111.661 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.468 ' N ' ' HZ ' ' B' ' 542' ' ' PHE . 61.2 p -64.76 123.71 84.22 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-N 115.827 -0.624 . . . . 1.05 110.898 -177.557 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.453 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 35.1 Cg_exo -54.97 157.16 13.76 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.658 2.239 . . . . 0.44 111.417 175.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.59 -19.78 65.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.224 -0.444 . . . . 1.21 111.814 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 t -93.29 -14.45 26.96 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.166 0.508 . . . . 1.94 110.443 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.453 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 17.6 m -65.95 137.39 57.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.672 -0.695 . . . . 1.13 111.299 177.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -50.55 -34.86 27.15 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-N 114.748 -1.115 . . . . 1.77 110.419 172.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.469 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 34.4 mmtt -86.3 149.99 24.66 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 113.449 -1.705 . . . . 2.18 112.123 -171.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.428 ' O ' ' HG3' ' A' ' 59' ' ' MET . 4.3 mtp -128.82 98.53 5.0 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.831 -1.077 . . . . 1.11 109.238 171.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.503 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.4 OUTLIER -156.49 156.33 33.54 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.651 -0.704 . . . . 1.05 111.045 -171.888 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.452 HD13 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -129.87 119.07 22.71 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.049 -1.093 . . . . 1.05 108.049 175.787 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.532 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 47.9 mtm180 -99.97 141.98 32.06 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.208 0.528 . . . . 3.5 110.788 -178.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.528 HD23 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -120.36 104.62 10.18 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 114.97 -1.014 . . . . 1.03 108.814 177.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.51 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.9 mp -84.37 97.21 4.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.285 -0.635 . . . . 1.11 109.285 -174.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.463 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -72.59 148.68 42.32 Favored Glycine 0 N--CA 1.442 -0.942 0 CA-C-N 115.461 -0.791 . . . . 0.54 111.904 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.443 ' HG2' ' HB2' ' A' ' 46' ' ' ASP . 91.9 mttt -68.57 154.12 42.48 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.027 0.441 . . . . 1.08 111.793 -176.563 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.456 HG11 ' HA ' ' A' ' 84' ' ' PRO . 0.7 OUTLIER -119.42 156.32 21.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.578 -0.737 . . . . 2.32 109.579 168.115 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.673 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 12.7 m-20 -84.42 79.7 9.47 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.384 -0.969 . . . . 3.23 108.384 174.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.47 -2.88 3.65 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.187 -0.46 . . . . 2.39 112.039 -171.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.7 p -67.9 -16.1 63.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.376 0.608 . . . . 3.2 110.336 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.673 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.5 ptpt -79.55 42.88 0.53 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.584 -0.735 . . . . 2.95 111.188 177.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -44.24 116.68 1.06 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.328 0.585 . . . . 3.72 109.921 -176.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -105.89 165.83 10.92 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.072 -0.967 . . . . 4.12 109.853 -166.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.581 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 61.7 mttp -130.63 139.35 50.38 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.925 -0.398 . . . . 4.59 109.925 170.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.484 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 2.9 p-10 -86.62 -168.6 2.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.017 -0.538 . . . . 4.41 110.377 -177.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -58.9 -31.2 68.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.705 0.288 . . . . 5.69 111.618 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.484 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 16.5 mt-10 -80.18 -14.9 58.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 5.38 110.898 -179.013 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.94 16.54 59.43 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.738 -0.744 . . . . 4.47 111.695 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.581 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 53.4 m-20 -77.11 138.98 39.84 Favored 'General case' 0 CA--C 1.512 -0.519 0 N-CA-C 109.043 -0.725 . . . . 4.72 109.043 178.383 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -69.79 90.08 0.59 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.49 -0.559 . . . . 4.28 109.49 176.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 27.9 m -96.32 123.87 48.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.565 0.698 . . . . 3.51 110.044 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.435 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 t -90.59 122.47 67.07 Favored Pre-proline 0 C--N 1.313 -1.002 0 N-CA-C 108.452 -0.944 . . . . 2.87 108.452 177.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 33.4 Cg_exo -62.57 136.82 60.73 Favored 'Trans proline' 0 CA--C 1.513 -0.574 0 C-N-CA 123.009 2.473 . . . . 2.06 111.642 -176.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.86 149.23 66.78 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.203 -0.908 . . . . 3.13 109.607 -177.289 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.456 ' HA ' HG11 ' A' ' 66' ' ' VAL . 23.0 Cg_exo -61.62 154.3 60.98 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.771 2.314 . . . . 0.99 111.99 -177.159 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 64' ' ' GLY . 40.9 mt-30 -68.65 153.05 44.49 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.659 -0.867 . . . . 2.11 108.659 178.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.425 ' HG2' HG13 ' A' ' 63' ' ' ILE . 92.5 mtm-85 -141.58 120.62 12.87 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.779 0.8 . . . . 3.17 111.503 -177.113 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.532 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 77.4 m-70 -95.73 146.83 24.21 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.266 -1.334 . . . . 0.72 107.785 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.503 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 27.6 ttm -140.29 125.91 19.17 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 118.891 0.769 . . . . 1.07 111.775 175.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.435 ' O ' ' HA ' ' A' ' 59' ' ' MET . 10.1 m-85 -112.82 127.26 56.12 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.39 -0.823 . . . . 0.27 109.842 178.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.446 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.6 OUTLIER -81.12 149.51 29.13 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.924 0.392 . . . . 1.68 110.284 177.388 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 25.0 m-85 -131.71 174.16 10.41 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.297 0.57 . . . . 0.32 111.533 -174.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -119.51 -21.18 7.5 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.017 -0.992 . . . . 2.7 109.572 175.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.456 ' HB2' HG23 ' A' ' 96' ' ' VAL . 11.1 m120 -130.55 126.89 37.9 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.046 -0.525 . . . . 1.16 110.525 -173.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.552 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 10.6 mmm180 -64.4 -32.86 74.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.627 -0.715 . . . . 3.7 111.874 178.083 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.2 m -62.34 -39.0 91.65 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.89 0.376 . . . . 1.13 110.937 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.553 ' O ' HG12 ' A' ' 100' ' ' ILE . 13.0 t -67.84 -55.21 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-N 116.025 -0.534 . . . . 1.06 110.384 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.552 ' SD ' ' HD2' ' A' ' 94' ' ' ARG . 13.2 ptp -59.05 -36.15 74.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.268 -0.424 . . . . 1.02 111.05 -176.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -64.35 -45.53 87.37 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.55 -0.296 . . . . 0.34 110.274 176.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -70.2 -42.91 71.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.999 -0.546 . . . . 1.58 111.868 -177.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.564 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 38.8 mm -61.41 -55.93 21.2 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 109.024 -0.732 . . . . 1.01 109.024 178.357 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.467 ' HD3' ' HB3' ' A' ' 50' ' ' ALA . 21.2 ttpp -51.36 -51.23 56.37 Favored 'General case' 0 C--O 1.218 -0.584 0 O-C-N 123.742 0.652 . . . . 1.47 110.05 177.029 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.592 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 45.8 ttp -46.82 -53.45 11.98 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.061 -0.972 . . . . 1.02 111.365 177.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.715 ' O ' HG13 ' A' ' 107' ' ' ILE . 20.0 m -62.56 -52.23 64.23 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.201 -0.454 . . . . 1.04 110.751 179.381 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 33.0 mt -47.22 -53.36 13.45 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.646 0.736 . . . . 1.04 110.62 175.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 101' ' ' LYS . 57.4 mt-30 -55.29 -39.8 70.32 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.258 -1.337 . . . . 1.96 112.125 177.43 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.592 ' HG2' ' O ' ' A' ' 102' ' ' MET . 25.9 mm-40 -69.25 -25.67 64.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.556 0.693 . . . . 3.11 110.218 178.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.715 HG13 ' O ' ' A' ' 103' ' ' THR . 18.4 mt -82.18 -46.15 19.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 114.952 -1.022 . . . . 1.03 111.08 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 104' ' ' LEU . 11.0 mt -62.68 -40.4 88.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.039 -0.528 . . . . 1.04 111.541 -176.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.5 p -61.44 -20.63 63.32 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.373 -0.376 . . . . 1.67 111.802 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -66.28 -51.99 51.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.587 0.708 . . . . 1.99 109.309 173.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.623 ' HH ' ' H ' ' A' ' 25' ' ' ALA . 51.8 m-85 -78.18 -16.58 57.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.081 -0.963 . . . . 1.0 110.374 -178.576 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -65.93 -36.16 82.6 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.392 -0.822 . . . . 1.46 109.329 174.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -79.34 -39.35 32.93 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-N 115.538 -0.756 . . . . 2.27 109.821 175.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -90.59 41.55 1.06 Allowed 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.268 -0.878 . . . . 1.47 110.808 -177.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.2 t70 . . . . . 0 C--O 1.247 0.962 0 CA-C-N 115.597 -0.729 . . . . 2.72 110.59 -176.709 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.672 0 N-CA-C 112.126 -0.39 . . . . 20.26 112.126 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 10.7 p -87.3 135.3 34.81 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.204 -0.295 . . . . 18.54 110.204 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.63 95.43 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.908 2.406 . . . . 17.79 112.022 177.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -84.94 -172.67 49.37 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.851 -0.69 . . . . 16.44 111.913 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -93.39 123.18 61.2 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-O 120.654 0.264 . . . . 16.12 110.343 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.69 65.89 3.87 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 123.241 2.627 . . . . 13.81 112.999 -178.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -125.61 17.68 8.12 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.147 -0.479 . . . . 12.88 110.141 178.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -84.15 -53.02 3.41 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.775 -0.726 . . . . 9.73 111.851 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . 0.47 HD11 ' N ' ' B' ' 527' ' ' LEU . 0.0 OUTLIER -132.34 -168.11 2.0 Allowed 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 120.345 0.117 . . . . 8.74 110.982 179.01 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 4.4 tt 53.22 47.16 25.0 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 107.944 -1.132 . . . . 10.79 107.944 -173.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 40.0 t 69.44 -60.05 0.47 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 114.27 -1.332 . . . . 7.62 110.157 -171.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 82.88 -59.1 5.01 Favored Glycine 0 N--CA 1.44 -1.049 0 N-CA-C 110.611 -0.995 . . . . 5.26 110.611 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 10.2 t70 169.44 -41.2 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 113.644 -1.278 . . . . 5.5 108.526 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . 0.435 ' HA ' ' OG ' ' B' ' 535' ' ' SER . 29.4 mt-10 -80.93 13.09 2.85 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.347 -1.751 . . . . 5.68 111.775 -167.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -95.67 -30.95 13.48 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.501 -1.227 . . . . 3.22 110.074 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -109.92 -33.36 6.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.976 -0.556 . . . . 5.14 110.511 178.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 535' ' ' SER . . . . . 0.478 ' O ' ' HB2' ' B' ' 539' ' ' ASP . 78.9 p -70.41 -19.88 62.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.632 -0.713 . . . . 1.34 110.373 -178.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 536' ' ' SER . . . . . 0.406 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 15.5 p -65.03 -41.08 95.57 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.215 0.531 . . . . 2.43 110.775 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 34.8 mm -79.27 -37.91 19.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.762 -0.654 . . . . 1.69 110.563 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -76.31 -1.53 27.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.848 0.833 . . . . 1.36 110.339 177.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.478 ' HB2' ' O ' ' B' ' 535' ' ' SER . 19.2 t70 -85.61 -47.83 9.47 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.418 -1.264 . . . . 1.23 109.588 175.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 49.4 ttm -57.83 -34.63 69.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.846 -1.07 . . . . 2.83 109.478 174.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -57.26 -42.54 81.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.254 -1.339 . . . . 1.18 111.233 176.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.468 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -67.64 -39.61 84.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.935 -0.575 . . . . 0.66 112.011 -170.989 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 34.0 m -61.4 -23.34 65.74 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 116.295 -0.411 . . . . 2.08 111.26 -178.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -83.47 -36.75 23.91 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.263 -0.426 . . . . 1.34 110.319 175.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.23 -40.58 97.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.935 -0.575 . . . . 1.82 112.439 -176.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 17.3 mt -77.46 -11.24 59.83 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.478 0.656 . . . . 1.54 110.256 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 52.2 m -112.5 42.02 1.91 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.143 -0.935 . . . . 1.92 110.697 176.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -104.5 4.27 32.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.491 . . . . 3.31 110.773 177.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 23.6 mm 58.86 55.78 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 115.263 -0.88 . . . . 5.68 110.321 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 17.9 m -95.63 -26.73 15.63 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.903 -0.589 . . . . 6.4 110.929 -178.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 C--O 1.251 1.159 0 CA-C-O 118.401 -0.809 . . . . 7.59 111.291 -179.895 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo . . . . . 0 N--CA 1.482 0.796 0 N-CA-C 111.377 -0.278 . . . . 2.47 111.377 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.415 ' O ' ' HB2' ' A' ' 3' ' ' HIS . 32.8 p -170.01 -39.59 0.02 OUTLIER 'General case' 0 C--O 1.234 0.248 0 C-N-CA 120.979 -0.288 . . . . 2.05 111.697 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.415 ' HB2' ' O ' ' A' ' 2' ' ' SER . 70.7 m80 70.3 -5.43 1.35 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.302 0.641 . . . . 1.08 112.235 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.0 p -150.63 165.31 33.76 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.089 0.774 . . . . 1.78 113.089 -170.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.436 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -179.76 -161.8 27.65 Favored Glycine 0 N--CA 1.443 -0.862 0 CA-C-N 114.472 -1.24 . . . . 0.16 110.434 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.92 133.53 47.88 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.438 0.619 . . . . 1.04 110.407 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.607 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -147.47 148.1 30.89 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.17 0.433 . . . . 1.02 112.17 -176.333 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.788 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.7 mt -107.66 124.19 63.54 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-O 120.818 0.342 . . . . 1.17 110.915 177.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -123.78 133.81 53.76 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.739 -0.837 . . . . 0.43 108.739 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 53.95 32.06 14.62 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 122.804 0.441 . . . . 0.8 110.947 -177.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.4 mtpt 70.98 -1.82 2.55 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.435 0.902 . . . . 2.57 113.435 178.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.4 p -92.56 118.78 38.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.792 -0.818 . . . . 1.1 108.792 169.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.3 p -72.93 145.93 46.45 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.161 -0.472 . . . . 1.5 110.656 -176.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . 0.417 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -163.82 -157.44 9.35 Favored Glycine 0 N--CA 1.439 -1.164 0 C-N-CA 120.106 -1.045 . . . . 0.12 113.214 -177.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.1 mm -126.17 132.12 70.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 109.404 -0.591 . . . . 1.02 109.404 -178.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.426 HD12 HD13 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -100.74 134.89 39.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.859 -0.423 . . . . 1.05 109.859 -177.453 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.4 128.78 28.12 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.502 -0.317 . . . . 1.04 111.443 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.414 HD11 ' HB ' ' A' ' 103' ' ' THR . 46.9 mt -85.46 138.67 18.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 121.267 0.556 . . . . 1.04 109.973 175.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -110.42 103.28 11.9 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 114.917 -1.038 . . . . 1.98 110.947 -175.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -116.58 169.05 9.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.319 -0.623 . . . . 1.2 109.319 175.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.7 t70 78.35 -3.31 2.31 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 122.251 1.025 . . . . 0.58 109.664 -176.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.63 HG21 ' O ' ' A' ' 23' ' ' SER . 27.1 m -102.82 -174.55 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 113.918 -1.492 . . . . 1.05 109.331 178.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.63 ' O ' HG21 ' A' ' 22' ' ' VAL . 64.6 m -72.94 167.92 29.46 Favored Pre-proline 0 C--N 1.314 -0.964 0 N-CA-C 105.404 -2.073 . . . . 1.77 105.404 175.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.401 ' O ' HG13 ' A' ' 41' ' ' VAL . 93.7 Cg_exo -41.15 129.34 3.11 Favored 'Trans proline' 0 C--N 1.354 0.82 0 CA-C-N 121.166 1.452 . . . . 0.19 112.531 -141.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.432 ' HB2' ' CG2' ' A' ' 107' ' ' ILE . . . -52.83 138.75 28.76 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 114.182 -1.372 . . . . 1.03 112.2 -162.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -118.89 167.44 11.72 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.094 -0.957 . . . . 0.32 111.797 -171.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.488 ' HB3' HG21 ' A' ' 40' ' ' VAL . 3.1 tm? -116.75 105.59 12.56 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 106.988 -1.486 . . . . 1.02 106.988 170.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 m -102.43 106.28 16.99 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 120.885 0.374 . . . . 1.02 110.801 -174.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -86.29 129.42 34.86 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 109.009 -0.737 . . . . 0.17 109.009 173.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.461 ' HG2' HG21 ' A' ' 37' ' ' VAL . 73.4 mtt180 -124.15 157.48 34.57 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.365 -0.976 . . . . 2.24 108.365 173.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 p -68.08 175.45 3.16 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.076 -0.712 . . . . 0.63 109.076 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.417 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 7.0 p -57.27 -44.27 83.8 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 118.362 0.528 . . . . 0.96 110.678 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -82.73 -26.38 32.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.753 -0.658 . . . . 2.12 109.719 172.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.13 16.49 47.17 Favored Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.184 -0.916 . . . . 0.23 112.885 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -62.16 -54.03 46.85 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.478 -0.564 . . . . 1.73 109.478 174.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt -80.93 140.3 35.37 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.517 -0.765 . . . . 1.91 109.186 176.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.461 HG21 ' HG2' ' A' ' 30' ' ' ARG . 14.9 p -149.32 134.81 11.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.022 0.439 . . . . 1.04 111.078 -178.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -139.83 129.16 24.01 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.484 -0.561 . . . . 0.54 109.484 178.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 25.1 m -117.56 129.26 55.67 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.262 0.468 . . . . 1.04 112.262 -172.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.488 HG21 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -97.3 128.99 48.02 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.629 0 N-CA-C 107.797 -1.186 . . . . 1.04 107.797 168.775 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.401 HG13 ' O ' ' A' ' 24' ' ' PRO . 68.0 t -92.72 120.8 42.68 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 N-CA-C 108.208 -1.034 . . . . 1.02 108.208 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -67.04 -20.7 65.89 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.19 0.811 . . . . 1.01 113.19 -169.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.7 p -68.41 -15.53 63.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.225 0.536 . . . . 1.07 109.906 175.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.2 p -106.26 9.93 31.91 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.531 -0.758 . . . . 1.03 109.874 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.474 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 25.7 mm -111.9 143.33 21.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.876 -0.602 . . . . 1.01 109.515 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -107.03 -44.69 4.33 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.392 -0.367 . . . . 0.52 110.72 -178.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.478 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 9.6 mtmm -138.92 171.53 14.19 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.452 -0.34 . . . . 1.95 111.212 -176.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.517 HD12 ' CG ' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -150.64 135.4 17.4 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.21 -0.663 . . . . 1.39 109.21 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.507 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 79.7 mm-40 -131.57 120.11 22.43 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 111.934 0.346 . . . . 2.02 111.934 -170.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.18 141.93 47.49 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 121.974 -0.454 . . . . 1.05 111.937 -177.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.6 p -68.58 121.96 82.88 Favored Pre-proline 0 N--CA 1.464 0.261 0 CA-C-N 115.848 -0.615 . . . . 1.05 110.712 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.482 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 11.1 Cg_exo -59.57 161.08 18.5 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.395 2.063 . . . . 0.44 111.433 175.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.84 -23.51 66.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.003 0.43 . . . . 1.21 110.748 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 42.5 m -76.41 -19.26 58.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.641 . . . . 1.94 110.648 176.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.482 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 73.2 m -78.15 134.47 37.65 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.373 -0.831 . . . . 1.13 110.316 177.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -57.96 -26.49 62.36 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 121.708 0.765 . . . . 1.77 110.673 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.571 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 42.4 mmtm -77.81 151.74 33.81 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 114.56 -1.2 . . . . 2.18 111.435 -176.488 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.556 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -127.31 95.57 4.31 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 107.927 -1.138 . . . . 1.11 107.927 168.628 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.571 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.13 151.66 28.54 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 121.62 0.724 . . . . 1.05 112.084 -173.537 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 97' ' ' MET . 1.9 tt -127.76 119.32 25.5 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.408 -1.269 . . . . 1.05 107.936 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.573 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 30.3 mtm180 -101.01 144.98 29.29 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.111 0.481 . . . . 3.5 111.119 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.53 HD23 HD12 ' A' ' 104' ' ' LEU . 1.1 mm? -122.64 106.18 10.74 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.208 -0.905 . . . . 1.03 109.097 178.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.577 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -85.34 98.77 6.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.742 -0.466 . . . . 1.11 109.742 -173.679 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.502 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -74.03 136.73 22.03 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.752 -0.658 . . . . 0.54 112.443 -178.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.474 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 82.0 mttt -53.63 132.82 41.31 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 112.831 0.678 . . . . 1.08 112.831 -176.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.66 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 0.9 OUTLIER -121.34 140.92 43.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.09 -0.959 . . . . 2.32 110.611 174.038 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.713 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 15.3 t70 -80.75 78.7 7.5 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.946 -1.024 . . . . 3.23 109.222 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -65.65 -3.49 4.78 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.676 0.621 . . . . 2.39 112.676 -169.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.0 p -75.89 -7.93 55.7 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.26 0.552 . . . . 3.2 110.239 170.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.713 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.9 ptmt -80.17 37.45 0.38 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.44 -0.8 . . . . 2.95 110.719 176.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.523 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 29.8 mmtm -45.23 114.54 0.75 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.945 -0.571 . . . . 3.72 110.354 -175.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.603 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.0 ttt180 -91.26 158.88 16.33 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 107.909 -1.145 . . . . 4.12 107.909 -176.415 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 97.3 mttt -134.4 140.56 46.38 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 109.535 -0.543 . . . . 4.59 109.535 174.737 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.464 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 1.6 p-10 -80.14 -169.46 2.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.126 -0.488 . . . . 4.41 110.527 -177.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -58.53 -31.75 68.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.727 0.298 . . . . 5.69 111.662 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.51 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 16.5 mt-10 -83.7 -32.42 25.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.744 0.307 . . . . 5.38 110.921 -178.009 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 113.78 18.24 7.04 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.594 -0.813 . . . . 4.47 112.32 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.51 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 32.2 m-80 -76.11 131.81 39.65 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.172 -0.677 . . . . 4.72 109.172 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.08 96.38 0.62 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.098 0.475 . . . . 4.28 109.932 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.603 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.7 m -105.45 99.32 8.24 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-O 121.605 0.716 . . . . 3.51 109.077 177.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.523 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -87.53 121.31 71.16 Favored Pre-proline 0 C--N 1.312 -1.033 0 CA-C-N 116.078 -0.51 . . . . 2.87 110.2 -177.723 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.434 ' HG2' ' HE2' ' A' ' 70' ' ' LYS . 52.1 Cg_exo -56.7 144.47 86.3 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.975 2.45 . . . . 2.06 112.135 -178.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.538 ' H ' ' HD3' ' A' ' 83' ' ' LYS . 0.9 OUTLIER -91.81 147.24 34.6 Favored Pre-proline 0 C--N 1.312 -1.03 0 N-CA-C 108.254 -1.017 . . . . 3.13 108.254 178.702 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.66 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 40.1 Cg_exo -52.64 147.08 32.07 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.566 2.177 . . . . 0.99 111.841 179.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -76.09 112.55 12.65 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-N 115.615 -0.721 . . . . 2.11 109.204 -172.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.511 ' HG3' ' O ' ' A' ' 84' ' ' PRO . 76.1 mtt180 -103.28 119.29 38.59 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.458 -0.792 . . . . 3.17 110.468 -170.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.573 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 66.0 m-70 -93.18 148.16 22.26 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 107.497 -1.297 . . . . 0.72 107.497 -177.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.556 ' SD ' ' HE2' ' A' ' 59' ' ' MET . 35.2 ttm -140.4 127.11 20.4 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 119.687 -0.805 . . . . 1.07 111.666 179.063 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.5 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 6.0 m-85 -118.11 130.04 55.9 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.418 -0.81 . . . . 0.27 109.536 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.788 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -79.71 159.33 26.68 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.718 -0.475 . . . . 1.68 109.718 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.458 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 28.8 m-85 -138.73 175.33 9.65 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 120.752 0.311 . . . . 0.32 110.765 -178.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -124.02 -12.3 7.49 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.851 -0.613 . . . . 2.7 109.823 173.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.442 ' HB2' HG23 ' A' ' 96' ' ' VAL . 46.6 m-80 -138.06 128.3 26.03 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.067 -0.515 . . . . 1.16 110.252 -177.595 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.538 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 13.9 mmm180 -67.24 -30.23 70.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.528 -0.76 . . . . 3.7 111.85 -179.604 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.9 m -61.88 -39.8 93.18 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.979 0.418 . . . . 1.13 110.549 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.569 ' O ' HG12 ' A' ' 100' ' ' ILE . 8.1 t -65.92 -56.03 16.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.899 -0.591 . . . . 1.06 110.4 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.538 ' SD ' ' HD2' ' A' ' 94' ' ' ARG . 14.8 ptp -57.44 -38.03 73.78 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 116.235 -0.439 . . . . 1.02 111.067 -176.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.53 -43.58 93.54 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.449 -0.5 . . . . 0.34 110.466 177.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -70.65 -39.28 73.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.141 -0.482 . . . . 1.58 111.585 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.569 HG12 ' O ' ' A' ' 96' ' ' VAL . 34.0 mm -63.89 -56.99 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 108.895 -0.779 . . . . 1.01 108.895 175.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.423 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 31.1 ttpt -49.99 -48.75 52.2 Favored 'General case' 0 C--O 1.22 -0.47 0 O-C-N 123.926 0.766 . . . . 1.47 109.793 176.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.668 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 41.9 ttp -49.09 -56.36 9.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.54 -0.755 . . . . 1.02 111.201 177.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.72 ' O ' HG13 ' A' ' 107' ' ' ILE . 32.3 m -58.5 -53.49 57.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.15 -0.477 . . . . 1.04 110.596 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.53 HD12 HD23 ' A' ' 62' ' ' LEU . 26.1 mt -47.5 -53.61 13.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.705 -0.68 . . . . 1.04 110.569 175.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.517 ' CG ' HD12 ' A' ' 48' ' ' LEU . 93.9 mt-30 -53.36 -44.06 68.27 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.524 -1.216 . . . . 1.96 112.182 176.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.668 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.7 mt-30 -62.95 -35.75 81.16 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.753 0.787 . . . . 3.11 109.086 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.72 HG13 ' O ' ' A' ' 103' ' ' THR . 9.3 mt -74.43 -45.63 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-N 114.326 -1.307 . . . . 1.03 111.417 -177.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.494 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.8 mt -63.8 -40.66 89.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.449 -0.341 . . . . 1.04 111.699 -177.242 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.7 t -56.31 -24.76 45.66 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.979 0.418 . . . . 1.67 111.045 -178.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -65.65 -40.94 93.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.214 0.53 . . . . 1.99 110.255 176.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -90.9 -16.78 27.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.635 -0.711 . . . . 1.0 109.984 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.24 -39.08 82.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.135 -0.939 . . . . 1.46 109.215 175.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -73.5 -38.3 65.41 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.539 -0.755 . . . . 2.27 109.782 174.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -92.55 52.07 1.84 Allowed 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 114.842 -1.072 . . . . 1.47 111.353 -175.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.539 -0.744 . . . . 2.72 109.773 176.979 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.585 0 N-CA-C 111.774 -0.53 . . . . 20.26 111.774 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 10.2 t -152.74 107.39 2.7 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-O 120.726 0.298 . . . . 18.54 110.418 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.62 136.85 60.63 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 123.092 2.528 . . . . 17.79 111.787 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -176.18 174.97 47.3 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.616 -0.802 . . . . 16.44 112.343 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . 0.491 ' CE2' ' HB2' ' B' ' 525' ' ' ASN . 37.5 t80 -107.68 106.36 58.28 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.882 -0.414 . . . . 16.12 109.882 178.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.1 -44.92 6.48 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.883 2.389 . . . . 13.81 113.293 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . 0.491 ' HB2' ' CE2' ' B' ' 523' ' ' TYR . 7.8 t30 61.0 87.23 0.09 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.167 0.508 . . . . 12.88 110.847 -178.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 179.31 89.18 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.989 -0.624 . . . . 9.73 111.663 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.95 76.61 6.65 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.289 0.566 . . . . 8.74 110.638 -176.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 49.9 tp -109.79 62.75 0.6 Allowed 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 107.268 -1.382 . . . . 10.79 107.268 167.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 27.4 m 61.63 37.93 15.73 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 114.802 -1.09 . . . . 7.62 108.149 -165.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -103.22 14.27 55.1 Favored Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 114.724 -1.125 . . . . 5.26 113.555 -171.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -91.43 -22.56 20.38 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.804 1.287 . . . . 5.5 107.613 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -82.54 -5.19 58.61 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 112.787 -2.006 . . . . 5.68 109.725 178.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -90.98 -18.72 24.19 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 113.928 -1.487 . . . . 3.22 110.317 -177.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -70.61 -2.4 14.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.024 -0.534 . . . . 5.14 110.828 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 13.6 p -66.02 -28.19 68.68 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.357 -0.608 . . . . 1.34 109.357 172.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 65.7 m -69.46 -31.81 70.35 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.353 -0.839 . . . . 2.43 110.774 175.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 18.6 mm -82.68 -35.88 12.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.057 0.456 . . . . 1.69 110.438 176.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -73.79 0.23 13.76 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.686 0.755 . . . . 1.36 110.588 177.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -74.34 -41.99 60.16 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.924 -1.035 . . . . 1.23 109.018 171.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 46.5 mtm -67.14 -27.39 67.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.134 -0.939 . . . . 2.83 110.098 175.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.19 -53.71 48.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.605 -0.725 . . . . 1.18 109.607 174.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.418 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -63.41 -35.05 79.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.81 -1.087 . . . . 0.66 111.702 -173.593 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 34.7 m -60.76 -31.68 71.01 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 116.26 -0.427 . . . . 2.08 111.788 -177.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -86.02 -27.33 24.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.033 0.444 . . . . 1.34 110.505 178.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . 0.464 ' O ' ' HG2' ' B' ' 548' ' ' GLN . 86.4 mt -72.27 -32.75 66.92 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.591 -0.732 . . . . 1.82 112.158 -177.096 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 20.3 mt -70.75 -27.6 64.07 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.474 0.654 . . . . 1.54 109.608 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 17.1 t -81.13 -65.74 0.97 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.019 -0.991 . . . . 1.92 110.29 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' B' ' 545' ' ' LEU . 14.0 mm100 49.12 47.87 21.51 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.49 0.662 . . . . 3.31 111.034 -176.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 62.4 mt -113.64 -40.38 3.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 114.994 -1.003 . . . . 5.68 109.269 176.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 27.9 m -128.0 67.85 1.34 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.321 -0.854 . . . . 6.4 109.566 177.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 8.5 t . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.683 -0.675 . . . . 7.59 109.745 -179.044 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo . . . . . 0 N--CA 1.479 0.626 0 N-CA-C 110.692 -0.542 . . . . 2.47 110.692 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.6 t 59.69 74.46 0.44 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.462 0.648 . . . . 2.05 111.451 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -81.46 -7.71 59.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.651 -0.704 . . . . 1.08 110.17 174.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.0 p -143.79 168.23 20.43 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.967 0.413 . . . . 1.78 111.541 -174.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.433 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.77 -159.01 23.18 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 110.824 -0.911 . . . . 0.16 110.824 -178.381 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.5 135.72 47.52 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 117.133 0.467 . . . . 1.04 110.176 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.499 ' HB3' ' HB3' ' A' ' 89' ' ' PHE . . . -151.68 140.78 21.22 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.043 0.386 . . . . 1.02 112.043 -177.139 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.734 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 87.0 mt -99.32 126.76 52.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.838 -0.43 . . . . 1.17 109.838 173.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -125.95 135.19 51.57 Favored 'General case' 0 C--O 1.215 -0.731 0 N-CA-C 108.433 -0.951 . . . . 0.43 108.433 178.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 57.98 26.04 12.97 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 122.68 0.392 . . . . 0.8 110.754 -177.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm 69.46 1.04 3.15 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.876 0.695 . . . . 2.57 112.876 -177.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.6 p -92.54 120.81 42.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 108.55 -0.907 . . . . 1.1 108.55 168.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.437 ' HA ' HG12 ' A' ' 8' ' ' ILE . 16.2 p -74.84 143.14 44.05 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.749 -0.66 . . . . 1.5 111.266 -174.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.82 -158.59 9.79 Favored Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.461 -0.876 . . . . 0.12 113.436 -177.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.409 HG21 ' O ' ' A' ' 5' ' ' GLY . 20.4 mm -127.78 132.6 68.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 C-N-CA 123.396 0.679 . . . . 1.02 109.362 -176.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.407 HD11 HD12 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -101.61 135.41 38.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.903 -0.406 . . . . 1.05 109.903 -176.708 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.15 130.21 28.62 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.499 0.19 . . . . 1.04 111.433 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.413 HD11 ' HB ' ' A' ' 103' ' ' THR . 53.8 mt -85.35 136.47 22.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.365 0.603 . . . . 1.04 109.921 175.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -108.47 99.7 9.06 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.935 -1.03 . . . . 1.98 111.038 -173.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.499 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 23.8 mt-10 -112.31 171.14 7.69 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.421 -0.955 . . . . 1.2 108.421 174.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 33.7 t70 79.68 -6.37 1.8 Allowed 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 122.44 1.114 . . . . 0.58 109.499 -177.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.67 HG22 ' O ' ' A' ' 23' ' ' SER . 23.4 m -103.53 -171.44 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 113.76 -1.564 . . . . 1.05 109.943 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.67 ' O ' HG22 ' A' ' 22' ' ' VAL . 60.2 p -72.02 168.62 21.24 Favored Pre-proline 0 C--N 1.319 -0.737 0 N-CA-C 105.31 -2.107 . . . . 1.77 105.31 174.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . 0.421 ' O ' HG11 ' A' ' 41' ' ' VAL . 72.8 Cg_exo -41.17 128.4 3.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 CA-C-N 121.594 1.605 . . . . 0.19 112.511 -146.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.462 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -49.2 139.9 10.41 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 114.195 -1.366 . . . . 1.03 112.482 -164.104 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -121.69 168.96 11.19 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 114.687 -1.142 . . . . 0.32 111.375 -170.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.492 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.99 107.02 13.54 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 107.141 -1.429 . . . . 1.02 107.141 170.258 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.559 HG22 ' OG1' ' A' ' 39' ' ' THR . 3.3 m -103.84 106.51 17.04 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-O 120.795 0.331 . . . . 1.02 110.875 -174.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.5 t90 -85.76 129.56 34.79 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 108.853 -0.795 . . . . 0.17 108.853 172.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.448 ' HG2' HG21 ' A' ' 37' ' ' VAL . 97.9 mtt180 -124.97 157.43 36.12 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.871 -0.789 . . . . 2.24 108.871 174.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -69.84 176.26 3.78 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.849 -0.426 . . . . 0.63 109.849 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.2 p -61.45 -30.58 70.67 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.237 -0.585 . . . . 0.96 111.258 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -94.94 -20.25 19.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.494 0.664 . . . . 2.12 109.626 171.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.407 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 84.7 17.15 64.31 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 114.824 -1.08 . . . . 0.23 112.635 177.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -67.38 -51.07 56.44 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.191 -0.67 . . . . 1.73 109.191 173.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -78.84 139.09 38.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.892 -0.781 . . . . 1.91 108.892 173.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.448 HG21 ' HG2' ' A' ' 30' ' ' ARG . 14.7 p -149.14 136.23 13.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 120.913 0.387 . . . . 1.04 110.739 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -144.2 127.0 16.25 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.77 -0.456 . . . . 0.54 109.77 177.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.559 ' OG1' HG22 ' A' ' 28' ' ' THR . 31.4 m -117.63 132.93 56.43 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.406 0.521 . . . . 1.04 112.406 -172.52 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -99.88 129.45 50.49 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 107.93 -1.137 . . . . 1.04 107.93 168.422 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.421 HG11 ' O ' ' A' ' 24' ' ' PRO . 93.3 t -93.25 121.59 44.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 O-C-N 121.044 -1.035 . . . . 1.02 108.544 172.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HB3' HG12 ' A' ' 108' ' ' ILE . 2.6 mm? -67.37 -21.24 65.62 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.32 0.859 . . . . 1.01 113.32 -169.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.1 p -69.37 -13.74 62.53 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.223 -0.591 . . . . 1.07 109.673 175.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.422 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 3.8 p -110.75 11.79 22.55 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.384 -0.826 . . . . 1.03 109.785 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.447 HD12 ' HA2' ' A' ' 64' ' ' GLY . 26.6 mm -110.75 140.76 28.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.071 -0.714 . . . . 1.01 109.071 177.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -104.8 -41.73 5.56 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.344 -0.389 . . . . 0.52 110.934 -177.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.481 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 9.7 mtmm -140.82 171.73 13.68 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.768 0.318 . . . . 1.95 111.247 -177.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.512 HD13 ' HG2' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -150.45 146.48 26.68 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.518 -0.919 . . . . 1.39 108.518 177.622 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.492 ' HG3' HD11 ' A' ' 63' ' ' ILE . 0.5 OUTLIER -142.68 120.96 12.28 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 121.211 -0.195 . . . . 2.02 110.943 -174.298 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.465 ' HB3' ' SD ' ' A' ' 97' ' ' MET . . . -117.2 152.16 35.37 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.9 -0.5 . . . . 1.05 111.467 -179.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.553 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 70.5 p -77.64 119.53 77.78 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.884 -0.598 . . . . 1.05 110.786 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.55 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 9.9 Cg_exo -60.7 165.47 11.63 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 122.711 2.274 . . . . 0.44 112.015 175.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.77 -21.29 63.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.146 0.498 . . . . 1.21 110.692 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 70.6 m -78.91 -16.94 56.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.758 -0.655 . . . . 1.94 110.961 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.55 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 30.1 m -77.32 142.07 39.59 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.802 0.811 . . . . 1.13 112.512 -177.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -55.4 -30.63 60.76 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 113.921 -1.49 . . . . 1.77 110.93 172.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.431 ' HE3' ' OD2' ' B' ' 541' ' ' ASP . 3.0 mptp? -93.27 156.2 16.96 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 114.025 -1.443 . . . . 2.18 111.966 -173.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.553 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 73.6 mmm -132.52 98.66 4.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.464 -0.789 . . . . 1.11 109.206 168.754 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.486 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.0 OUTLIER -158.18 159.49 36.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.573 -0.74 . . . . 1.05 111.395 -170.286 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.582 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.5 tt -134.81 120.14 19.01 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.819 -0.808 . . . . 1.05 108.819 177.609 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.673 ' NE ' ' HG2' ' A' ' 86' ' ' ARG . 1.9 mtp180 -105.33 146.46 29.35 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.1 0.476 . . . . 3.5 111.787 -176.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.524 HD23 HD12 ' A' ' 104' ' ' LEU . 1.1 mm? -127.4 114.67 17.83 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.088 -0.96 . . . . 1.03 109.648 -177.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.603 ' N ' HD13 ' A' ' 63' ' ' ILE . 1.8 mp -90.74 102.26 13.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 120.936 0.398 . . . . 1.11 110.826 -172.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.447 ' HA2' HD12 ' A' ' 45' ' ' ILE . . . -70.56 137.0 26.79 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.732 -0.667 . . . . 0.54 111.972 178.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.422 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 90.5 mttt -61.4 129.93 43.62 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.305 0.574 . . . . 1.08 112.39 -175.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.635 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.4 t -121.11 144.5 29.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.23 -0.896 . . . . 2.32 110.163 171.655 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -77.78 88.44 4.01 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.708 -0.678 . . . . 3.23 109.416 176.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -76.14 -2.47 31.19 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.275 0.559 . . . . 2.39 110.465 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 p -92.13 2.2 56.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.692 -0.686 . . . . 3.2 109.952 172.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 4.3 ptmm? -90.57 20.56 4.52 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.588 -0.733 . . . . 2.95 110.285 -178.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.2 mtmt -40.95 114.9 0.52 Allowed 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.765 0.793 . . . . 3.72 111.031 -158.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.568 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 78.3 ttt180 -88.38 163.93 15.77 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.345 -1.298 . . . . 4.12 109.131 -168.164 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 93.4 mttt -129.49 143.1 50.69 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.287 -0.634 . . . . 4.59 109.287 172.072 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 40.5 p30 -82.25 -167.43 1.57 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.301 -0.409 . . . . 4.41 110.766 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -69.42 -20.47 63.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.776 0.322 . . . . 5.69 111.56 -177.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.532 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 17.0 mt-10 -89.12 -28.17 20.25 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.039 0.447 . . . . 5.38 109.966 -178.768 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 109.89 16.99 10.01 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.97 -0.633 . . . . 4.47 111.912 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.532 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 45.0 m-80 -78.46 138.94 38.71 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.51 -0.552 . . . . 4.72 109.51 178.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -70.15 102.03 1.99 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.29 -0.633 . . . . 4.28 109.29 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.568 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 15.8 m -113.43 98.69 7.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-O 121.791 0.805 . . . . 3.51 109.281 177.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 2.0 p -92.1 112.81 56.81 Favored Pre-proline 0 C--N 1.315 -0.903 0 CA-C-O 121.256 0.551 . . . . 2.87 110.154 -177.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.502 ' HG2' ' HD3' ' A' ' 70' ' ' LYS . 87.9 Cg_exo -53.48 141.84 60.85 Favored 'Trans proline' 0 CA--C 1.518 -0.318 0 C-N-CA 123.683 2.922 . . . . 2.06 112.985 -176.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.469 ' HD3' ' N ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -95.37 149.1 35.67 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 115.344 -0.844 . . . . 3.13 109.674 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.635 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 27.4 Cg_exo -59.3 147.53 90.51 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.639 2.226 . . . . 0.99 111.982 177.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -87.06 113.46 22.83 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 115.534 -0.757 . . . . 2.11 109.361 -174.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.673 ' HG2' ' NE ' ' A' ' 61' ' ' ARG . 18.2 ttp180 -102.4 122.7 44.8 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.238 -0.892 . . . . 3.17 110.714 -171.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.447 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 85.7 m-70 -92.8 155.87 17.37 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.12 -1.4 . . . . 0.72 108.082 -175.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.486 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 28.0 ttm -141.02 140.16 34.26 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 118.278 0.49 . . . . 1.07 110.586 174.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.499 ' HB3' ' HB3' ' A' ' 7' ' ' ALA . 13.4 m-85 -125.38 158.53 34.06 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 108.468 -0.938 . . . . 0.27 108.468 171.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.734 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 5.2 p -99.12 160.42 14.28 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 109.136 -0.69 . . . . 1.68 109.136 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . 0.582 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 38.5 m-85 -145.87 162.82 36.86 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.156 0.503 . . . . 0.32 111.746 176.056 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -123.08 0.5 9.08 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.486 -0.779 . . . . 2.7 109.836 174.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -146.85 126.82 13.63 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.661 -0.7 . . . . 1.16 109.922 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.598 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.8 mmm180 -66.26 -38.59 88.19 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.184 -0.462 . . . . 3.7 111.584 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.3 m -62.45 -24.22 67.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.05 0.453 . . . . 1.13 110.505 -175.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.611 ' O ' HG12 ' A' ' 100' ' ' ILE . 11.9 t -76.14 -59.58 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 N-CA-C 109.537 -0.542 . . . . 1.06 109.537 173.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.598 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.2 ptp -58.23 -41.78 84.86 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.602 -0.272 . . . . 1.02 111.161 -176.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.51 ' N ' ' HG3' ' A' ' 97' ' ' MET . 32.4 t70 -60.61 -40.81 93.2 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.097 -0.641 . . . . 0.34 110.39 177.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 14.0 m-20 -74.12 -40.91 62.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.177 -0.465 . . . . 1.58 111.744 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.611 HG12 ' O ' ' A' ' 96' ' ' VAL . 34.4 mm -61.08 -56.96 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.333 0 N-CA-C 108.51 -0.922 . . . . 1.01 108.51 175.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.5 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 30.0 ttpt -50.96 -50.17 58.62 Favored 'General case' 0 C--O 1.216 -0.674 0 O-C-N 124.033 0.833 . . . . 1.47 109.72 177.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.484 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.5 ttp -49.91 -55.31 14.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.757 -0.656 . . . . 1.02 111.273 178.212 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.721 ' O ' HG13 ' A' ' 107' ' ' ILE . 53.6 m -57.44 -54.58 45.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.136 -0.484 . . . . 1.04 110.353 178.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 100' ' ' ILE . 26.8 mt -46.97 -56.13 6.94 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 123.333 0.653 . . . . 1.04 110.714 176.316 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.512 ' HG2' HD13 ' A' ' 48' ' ' LEU . 46.6 mt-30 -49.47 -47.43 48.45 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.693 -1.139 . . . . 1.96 112.032 177.382 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 102' ' ' MET . 15.9 mm100 -65.99 -36.78 84.23 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.786 0.803 . . . . 3.11 109.903 -177.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.721 HG13 ' O ' ' A' ' 103' ' ' THR . 8.3 mt -69.12 -44.38 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 CA-C-N 114.526 -1.216 . . . . 1.03 110.721 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.502 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.0 mt -64.56 -43.51 96.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.188 -0.46 . . . . 1.04 111.315 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.7 t -55.05 -28.51 52.81 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.213 0.32 . . . . 1.67 111.144 -178.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 106' ' ' GLN . 91.8 mtt180 -60.5 -51.02 71.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.482 0.658 . . . . 1.99 109.671 175.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -80.88 -15.13 57.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.339 -0.846 . . . . 1.0 110.468 -179.041 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -37.09 78.45 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.074 -0.713 . . . . 1.46 109.074 175.743 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -72.52 -37.83 68.23 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.382 -0.826 . . . . 2.27 109.868 173.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -92.59 51.94 1.81 Allowed 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 115.103 -0.953 . . . . 1.47 110.757 -176.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.376 -0.821 . . . . 2.72 110.641 -177.302 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 111.843 -0.503 . . . . 20.26 111.843 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 45.8 m -127.12 88.93 53.14 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-O 120.802 0.334 . . . . 18.54 111.06 -178.231 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -79.33 176.25 9.88 Favored 'Trans proline' 0 C--O 1.237 0.461 0 C-N-CA 122.888 2.392 . . . . 17.79 112.22 178.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 68.38 32.11 75.13 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 121.054 -0.593 . . . . 16.44 111.977 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -158.12 121.49 2.12 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 110.043 -0.355 . . . . 16.12 110.043 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -79.89 -171.37 1.23 Allowed 'Trans proline' 0 N--CA 1.463 -0.287 0 C-N-CA 122.716 2.277 . . . . 13.81 112.435 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -72.02 -56.77 5.06 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.903 0.383 . . . . 12.88 110.388 179.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -121.35 -169.93 13.82 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.92 -0.657 . . . . 9.73 112.151 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . 0.44 ' C ' ' H ' ' B' ' 529' ' ' SER . 1.1 pt? -117.8 14.7 14.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.862 0.363 . . . . 8.74 111.037 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 62.1 mt -77.71 27.75 0.17 Allowed 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.059 -0.518 . . . . 10.79 111.874 -175.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 529' ' ' SER . . . . . 0.44 ' H ' ' C ' ' B' ' 527' ' ' LEU . 37.6 t -148.5 17.18 1.03 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.333 -0.618 . . . . 7.62 109.333 175.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -76.08 -83.11 0.47 Allowed Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.68 -0.691 . . . . 5.26 112.397 -176.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -139.2 -17.44 1.03 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.265 0.555 . . . . 5.5 111.341 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -89.01 -7.32 56.18 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.047 0.927 . . . . 5.68 110.039 -177.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -74.05 -32.2 63.21 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 114.104 -1.407 . . . . 3.22 109.856 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -69.34 -31.35 69.73 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.53 -0.759 . . . . 5.14 110.81 -178.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 1.2 p -85.66 -15.43 42.41 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.136 -0.484 . . . . 1.34 110.654 176.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 536' ' ' SER . . . . . 0.454 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 50.3 m -81.51 -37.46 27.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.941 -0.572 . . . . 2.43 110.014 174.114 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 25.1 mm -72.87 -33.82 44.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.382 0.61 . . . . 1.69 109.674 172.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -80.96 13.28 2.78 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.671 0.748 . . . . 1.36 110.422 174.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.491 ' HA ' ' NH1' ' A' ' 61' ' ' ARG . 21.6 t70 -94.39 -43.6 8.31 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.26 -0.882 . . . . 1.23 108.769 173.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 4.7 mpp? -64.65 -22.62 67.02 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.578 -0.737 . . . . 2.83 109.713 169.31 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . 0.431 ' OD2' ' HE3' ' A' ' 57' ' ' LYS . 33.9 t70 -59.73 -46.16 89.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.194 -0.912 . . . . 1.18 110.774 175.386 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.56 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.4 OUTLIER -71.71 -31.13 66.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.457 -0.792 . . . . 0.66 112.048 -169.28 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -44.59 97.08 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-O 121.064 0.459 . . . . 2.08 110.729 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -77.13 -24.05 51.67 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.082 -0.508 . . . . 1.34 110.172 176.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -64.39 -45.53 87.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.48 -0.782 . . . . 1.82 111.374 -178.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . 0.484 HD11 ' HB3' ' A' ' 49' ' ' GLN . 96.0 mt -75.39 -35.99 60.97 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.325 0.583 . . . . 1.54 110.256 178.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 51.7 m -60.51 -73.65 0.09 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.804 -1.089 . . . . 1.92 111.146 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 49.02 38.08 11.82 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.116 0.484 . . . . 3.31 111.447 -177.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 19.2 pt -106.96 -33.52 2.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.98 -0.555 . . . . 5.68 110.676 -177.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 9.0 t 53.85 54.66 9.48 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 109.77 -0.456 . . . . 6.4 109.77 -178.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 8.1 t . . . . . 0 C--O 1.25 1.096 0 CA-C-N 115.201 -0.909 . . . . 7.59 110.159 -176.298 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . 0.444 ' HB2' ' OD1' ' A' ' 99' ' ' ASN . 15.0 Cg_exo . . . . . 0 N--CA 1.479 0.674 0 N-CA-C 111.011 -0.419 . . . . 2.47 111.011 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.482 ' O ' ' HB3' ' A' ' 99' ' ' ASN . 22.9 t -162.96 95.22 0.86 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.307 0.575 . . . . 2.05 110.461 177.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.562 ' HB2' ' HB ' ' A' ' 18' ' ' ILE . 22.4 p-80 -107.72 31.31 5.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.829 0.823 . . . . 1.08 109.412 173.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 55.0 p -160.46 148.25 16.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.09 -0.959 . . . . 1.78 110.584 171.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.433 ' O ' HG23 ' A' ' 15' ' ' ILE . . . -175.21 -153.81 10.58 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.105 -0.798 . . . . 0.16 111.105 -177.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.63 140.28 38.26 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 117.09 0.445 . . . . 1.04 110.001 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.428 ' HB2' ' HB3' ' A' ' 89' ' ' PHE . . . -152.04 144.36 24.02 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.071 0.462 . . . . 1.02 111.506 -178.505 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.512 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 81.8 mt -109.75 106.59 21.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.063 -0.517 . . . . 1.17 110.415 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -106.3 138.65 42.1 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 108.762 -0.829 . . . . 0.43 108.762 -178.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 53.66 22.17 2.96 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.912 0.485 . . . . 0.8 111.504 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt 66.97 16.84 10.44 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.906 -0.588 . . . . 2.57 111.724 -178.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.451 HG12 ' CH2' ' A' ' 29' ' ' TRP . 2.3 p -102.52 117.35 47.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 107.467 -1.309 . . . . 1.1 107.467 163.429 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -74.4 145.32 43.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.994 0.425 . . . . 1.5 111.093 -172.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -166.49 -159.38 12.17 Favored Glycine 0 N--CA 1.437 -1.299 0 C-N-CA 120.111 -1.043 . . . . 0.12 113.408 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.433 HG23 ' O ' ' A' ' 5' ' ' GLY . 14.7 mm -124.89 132.09 71.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 114.94 -0.63 . . . . 1.02 109.475 -176.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.42 HD13 HD12 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -101.24 134.16 42.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.794 -0.447 . . . . 1.05 109.794 -177.696 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.29 124.37 22.95 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.364 -0.38 . . . . 1.04 110.933 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ILE . . . . . 0.562 ' HB ' ' HB2' ' A' ' 3' ' ' HIS . 22.8 mt -84.58 127.17 40.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.385 -0.598 . . . . 1.04 109.385 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -97.7 101.87 13.48 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.864 -0.607 . . . . 1.98 110.533 -173.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -116.41 169.05 9.61 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.136 -0.69 . . . . 1.2 109.136 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.9 t70 75.92 -1.63 2.93 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 122.151 0.977 . . . . 0.58 109.971 -177.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.628 HG23 ' O ' ' A' ' 23' ' ' SER . 32.7 m -103.06 -173.89 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 114.249 -1.341 . . . . 1.05 109.848 179.223 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.628 ' O ' HG23 ' A' ' 22' ' ' VAL . 47.8 m -72.92 167.51 33.28 Favored Pre-proline 0 C--N 1.319 -0.753 0 N-CA-C 105.157 -2.164 . . . . 1.77 105.157 173.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -41.53 126.82 3.15 Favored 'Trans proline' 0 C--N 1.357 0.974 0 CA-C-N 121.413 1.54 . . . . 0.19 112.27 -140.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.435 ' HB1' HG23 ' A' ' 107' ' ' ILE . . . -51.35 140.76 16.6 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-N 114.227 -1.351 . . . . 1.03 112.371 -165.484 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -124.33 169.13 12.1 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 114.126 -1.397 . . . . 0.32 111.506 -169.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.532 HD21 HG12 ' A' ' 18' ' ' ILE . 3.2 tm? -117.32 104.61 11.32 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.471 -1.307 . . . . 1.02 107.471 173.499 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.406 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.6 m -100.07 106.16 17.88 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 120.795 -0.362 . . . . 1.02 110.593 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.451 ' CH2' HG12 ' A' ' 12' ' ' VAL . 81.6 t90 -87.07 131.48 34.11 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.697 -0.853 . . . . 0.17 108.697 171.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.464 ' HG2' HG23 ' A' ' 37' ' ' VAL . 72.3 mtt180 -126.01 158.58 34.96 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.969 -0.752 . . . . 2.24 108.969 174.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.9 p -68.42 173.11 5.2 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.789 -0.819 . . . . 0.63 108.789 177.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -56.17 -40.67 74.25 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.572 -0.451 . . . . 0.96 111.398 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -87.83 -22.91 24.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.581 0.705 . . . . 2.12 109.824 173.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 92.73 16.84 47.1 Favored Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 114.964 -1.016 . . . . 0.23 112.481 178.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -59.83 -51.8 68.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.293 0.568 . . . . 1.73 109.52 173.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -88.29 144.01 26.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.306 -0.861 . . . . 1.91 109.24 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' VAL . . . . . 0.464 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.6 p -149.3 138.12 15.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.806 0.336 . . . . 1.04 110.941 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -144.09 121.46 11.65 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.645 -0.502 . . . . 0.54 109.645 177.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.436 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 48.1 m -110.79 130.47 55.57 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 111.955 0.354 . . . . 1.04 111.955 -175.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.483 HG23 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -99.56 129.76 49.62 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.77 0 N-CA-C 108.253 -1.018 . . . . 1.04 108.253 169.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.415 ' O ' HG12 ' A' ' 45' ' ' ILE . 64.5 t -92.79 119.03 39.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 O-C-N 121.144 -0.973 . . . . 1.02 108.875 173.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.412 HD13 HD23 ' A' ' 104' ' ' LEU . 2.7 mm? -67.25 -16.47 64.3 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 112.47 0.545 . . . . 1.01 112.47 -171.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.529 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 96.8 p -71.66 -14.36 62.02 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.26 -0.644 . . . . 1.07 109.26 176.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.3 p -110.1 6.6 22.99 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.321 -0.854 . . . . 1.03 109.871 -179.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.505 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 27.9 mm -107.83 141.33 23.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.652 -0.704 . . . . 1.01 109.268 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -99.29 -45.42 5.88 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.249 -0.432 . . . . 0.52 110.449 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.425 ' C ' HD22 ' A' ' 48' ' ' LEU . 10.5 mtmm -141.86 174.05 10.94 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.372 0.606 . . . . 1.95 111.83 -175.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.588 ' CD2' ' HG2' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -137.56 152.59 49.6 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 107.261 -1.385 . . . . 1.39 107.261 174.488 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.525 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -144.05 118.95 9.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.298 0.499 . . . . 2.02 110.618 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.504 ' HB2' ' SD ' ' A' ' 97' ' ' MET . . . -116.67 141.57 48.02 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 122.195 -0.316 . . . . 1.05 111.444 -178.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.445 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 81.3 p -68.74 119.78 71.39 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 115.952 -0.567 . . . . 1.05 110.753 -175.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.547 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 7.7 Cg_exo -60.56 163.43 15.45 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.646 2.231 . . . . 0.44 112.125 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.01 -21.73 66.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.707 -0.679 . . . . 1.21 111.576 -177.211 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.9 m -96.51 6.31 48.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.009 -0.541 . . . . 1.94 110.673 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.547 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 42.7 m -89.62 145.52 25.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.009 -0.541 . . . . 1.13 110.839 174.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -53.73 -23.39 11.57 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 114.935 -1.03 . . . . 1.77 111.666 175.799 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.609 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 43.2 mmtm -105.2 161.53 14.19 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 114.326 -1.306 . . . . 2.18 112.397 -164.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.445 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 83.9 mmm -131.68 97.21 4.15 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.847 -1.07 . . . . 1.11 108.528 166.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.609 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.2 OUTLIER -154.14 157.37 38.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.191 0.519 . . . . 1.05 111.676 -172.99 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 97' ' ' MET . 1.7 tt -133.63 119.59 19.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.478 -0.934 . . . . 1.05 108.478 177.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.603 ' HG2' ' HB2' ' A' ' 88' ' ' MET . 8.4 mtp180 -103.88 140.88 37.06 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.219 0.533 . . . . 3.5 111.552 -178.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.614 HD21 ' CD1' ' A' ' 104' ' ' LEU . 1.8 mm? -115.36 111.52 20.97 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.935 -1.029 . . . . 1.03 109.599 176.801 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ILE . . . . . 0.617 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -91.71 98.35 8.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.354 -0.384 . . . . 1.11 110.519 -169.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -68.18 144.23 42.54 Favored Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.666 -0.697 . . . . 0.54 112.039 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.505 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 81.5 mttt -64.06 126.06 26.47 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 113.213 0.82 . . . . 1.08 113.213 -173.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.637 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 0.9 OUTLIER -120.78 143.47 32.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 114.565 -1.198 . . . . 2.32 109.916 171.957 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.75 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 22.7 t70 -86.59 83.06 7.7 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.175 -0.676 . . . . 3.23 109.175 177.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -62.8 -6.71 3.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.621 0.6 . . . . 2.39 112.621 -170.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -77.07 -4.08 42.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.069 0.462 . . . . 3.2 110.757 172.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.75 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.0 ptmt -82.2 41.93 0.71 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.852 -0.613 . . . . 2.95 110.326 175.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.551 ' HE2' ' OE1' ' A' ' 79' ' ' GLU . 23.5 mmtm -44.49 115.11 0.79 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.594 -0.73 . . . . 3.72 110.437 -176.295 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.653 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 77.7 ttt180 -95.68 165.87 12.1 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 107.708 -1.219 . . . . 4.12 107.708 -176.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -128.6 131.95 48.16 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 118.904 0.775 . . . . 4.59 111.215 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -73.21 172.14 11.68 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.449 -1.25 . . . . 4.41 110.236 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -51.79 -31.54 27.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.955 0.407 . . . . 5.69 111.405 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -94.18 15.87 16.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.38 -0.373 . . . . 5.38 111.694 -176.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.51 11.77 80.18 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.348 -0.387 . . . . 4.47 113.016 176.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -73.51 131.9 42.28 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.244 -0.651 . . . . 4.72 109.244 176.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.551 ' OE1' ' HE2' ' A' ' 71' ' ' LYS . 26.8 tt0 -68.09 95.28 0.55 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.61 -0.515 . . . . 4.28 109.61 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' VAL . . . . . 0.653 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 10.8 m -102.5 99.46 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 CA-C-O 121.732 0.777 . . . . 3.51 109.277 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.519 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.1 p -82.61 117.76 69.58 Favored Pre-proline 0 C--N 1.308 -1.239 0 CA-C-N 115.704 -0.68 . . . . 2.87 109.776 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.524 ' HG2' ' HE2' ' A' ' 70' ' ' LYS . 52.9 Cg_exo -54.95 138.88 78.96 Favored 'Trans proline' 0 CA--C 1.511 -0.653 0 C-N-CA 123.282 2.655 . . . . 2.06 112.725 -174.445 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.9 mmmm -82.04 140.03 46.21 Favored Pre-proline 0 N--CA 1.422 -1.868 0 CA-C-N 115.212 -0.904 . . . . 3.13 110.936 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.637 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 26.5 Cg_exo -59.35 146.52 94.55 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.391 2.061 . . . . 0.99 110.588 175.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -78.04 113.97 16.48 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.508 0.67 . . . . 2.11 109.951 -173.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.446 ' HG2' HG13 ' A' ' 63' ' ' ILE . 97.2 mtt180 -107.27 121.01 43.69 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 115.379 -0.828 . . . . 3.17 110.738 -171.237 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' HIS . . . . . 0.551 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 58.2 m-70 -94.55 110.87 22.64 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.598 -0.89 . . . . 0.72 108.598 -176.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.603 ' HB2' ' HG2' ' A' ' 61' ' ' ARG . 20.1 ttm -108.4 122.1 46.3 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 119.736 -0.786 . . . . 1.07 111.654 -175.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.428 ' HB3' ' HB2' ' A' ' 7' ' ' ALA . 5.9 m-85 -112.08 130.75 55.78 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.035 -0.984 . . . . 0.27 109.65 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' SER . . . . . 0.512 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -80.99 151.6 28.39 Favored 'General case' 0 C--N 1.316 -0.886 0 O-C-N 122.035 -0.415 . . . . 1.68 110.526 177.122 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -133.52 174.39 10.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.231 -0.441 . . . . 0.32 111.149 -175.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -115.71 -22.16 9.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.547 -0.751 . . . . 2.7 111.032 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -141.37 142.29 33.78 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.969 0.414 . . . . 1.16 110.528 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.595 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.0 mmm180 -67.61 -33.22 74.54 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.581 -0.736 . . . . 3.7 111.326 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.6 m -59.9 -38.75 83.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.17 -0.468 . . . . 1.13 110.512 -175.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.558 ' O ' HG12 ' A' ' 100' ' ' ILE . 6.6 t -67.71 -56.06 14.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.19 -0.459 . . . . 1.06 109.952 177.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' MET . . . . . 0.595 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.4 ptp -60.12 -41.09 91.88 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.422 -0.354 . . . . 1.02 111.2 -177.016 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.453 ' N ' ' HG3' ' A' ' 97' ' ' MET . 24.6 t70 -61.96 -39.04 90.78 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 120.0 -0.68 . . . . 0.34 110.534 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.482 ' HB3' ' O ' ' A' ' 2' ' ' SER . 7.7 m-80 -72.96 -43.92 61.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.38 -0.373 . . . . 1.58 111.393 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.597 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 33.2 mm -60.49 -56.02 20.51 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 N-CA-C 108.703 -0.851 . . . . 1.01 108.703 176.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.558 ' HE3' ' NE2' ' A' ' 105' ' ' GLN . 29.4 ttpt -52.43 -48.35 65.81 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 115.403 -0.817 . . . . 1.47 109.836 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.689 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 32.3 ttp -47.56 -59.47 3.23 Favored 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 123.812 0.695 . . . . 1.02 111.099 176.511 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' THR . . . . . 0.775 ' O ' HG13 ' A' ' 107' ' ' ILE . 24.3 m -56.41 -50.43 71.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.939 -0.573 . . . . 1.04 110.227 -178.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.614 ' CD1' HD21 ' A' ' 62' ' ' LEU . 25.8 mt -49.0 -56.15 9.82 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 121.342 0.591 . . . . 1.04 110.232 175.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.588 ' HG2' ' CD2' ' A' ' 48' ' ' LEU . 94.0 mt-30 -52.18 -43.12 64.0 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.778 -1.101 . . . . 1.96 112.177 176.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' GLN . . . . . 0.689 ' HG3' ' O ' ' A' ' 102' ' ' MET . 22.2 mt-30 -66.07 -38.95 89.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 122.035 0.922 . . . . 3.11 109.013 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ILE . . . . . 0.775 HG13 ' O ' ' A' ' 103' ' ' THR . 7.8 mt -72.73 -45.57 56.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 114.196 -1.365 . . . . 1.03 111.531 -177.476 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ILE . . . . . 0.581 HG13 ' O ' ' A' ' 104' ' ' LEU . 19.1 mt -58.67 -44.07 89.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 112.226 0.454 . . . . 1.04 112.226 -176.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' SER . . . . . 0.65 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 12.6 t -66.49 -15.69 63.56 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.776 -0.37 . . . . 1.67 111.865 -176.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -59.42 -35.5 74.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.619 0.723 . . . . 1.99 109.129 168.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.529 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 33.7 m-85 -97.14 -16.93 20.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.905 -1.043 . . . . 1.0 110.61 -177.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LYS . . . . . 0.65 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 9.1 mmpt? -68.49 -26.52 65.51 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.155 -0.684 . . . . 1.46 109.155 172.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.0 0.19 56.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.36 -0.836 . . . . 2.27 110.486 173.794 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -134.97 56.47 1.85 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.844 -0.616 . . . . 1.47 111.083 -178.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.305 -0.855 . . . . 2.72 109.789 178.842 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.655 0 N-CA-C 111.968 -0.453 . . . . 20.26 111.968 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 23.2 t -141.37 75.75 22.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 120.909 0.385 . . . . 18.54 110.298 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -89.18 38.53 0.42 Allowed 'Trans proline' 0 CA--C 1.531 0.335 0 C-N-CA 123.095 2.53 . . . . 17.79 112.718 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 67.79 48.45 55.25 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.751 -0.738 . . . . 16.44 111.702 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -107.67 123.29 38.37 Favored Pre-proline 0 C--N 1.32 -0.699 0 N-CA-C 110.476 -0.194 . . . . 16.12 110.476 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -61.11 150.33 84.88 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.73 2.287 . . . . 13.81 111.18 175.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -55.03 101.38 0.05 OUTLIER 'General case' 0 C--O 1.234 0.279 0 O-C-N 123.367 0.417 . . . . 12.88 111.023 -179.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 526' ' ' GLY . . . . . 0.41 ' C ' ' H ' ' B' ' 528' ' ' LEU . . . -87.88 82.77 1.55 Allowed Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.74 -0.664 . . . . 9.73 111.573 179.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 527' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' B' ' 530' ' ' GLY . 0.5 OUTLIER -78.21 33.72 0.19 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.154 0.502 . . . . 8.74 111.619 -178.003 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 528' ' ' LEU . . . . . 0.431 ' O ' HD21 ' B' ' 528' ' ' LEU . 10.4 tt -65.06 -18.38 65.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.732 0.777 . . . . 10.79 109.414 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 5.4 p -130.45 13.77 5.51 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.871 -1.059 . . . . 7.62 109.495 178.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 530' ' ' GLY . . . . . 0.488 ' O ' ' HB2' ' B' ' 527' ' ' LEU . . . -140.05 49.18 0.81 Allowed Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 114.849 -1.069 . . . . 5.26 110.887 -178.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -97.46 -4.35 38.27 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 122.605 1.193 . . . . 5.5 108.053 -172.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -91.33 -9.57 44.48 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.608 -1.633 . . . . 5.68 109.549 174.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -85.21 -26.49 26.71 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.834 -1.53 . . . . 3.22 111.987 -172.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -65.44 -16.83 64.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.445 0.64 . . . . 5.14 110.405 -177.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 535' ' ' SER . . . . . 0.407 ' O ' ' HB2' ' B' ' 539' ' ' ASP . 96.5 p -73.41 -12.75 60.91 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.486 -0.779 . . . . 1.34 110.624 -177.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 26.0 m -75.95 -37.07 59.04 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.121 0.486 . . . . 2.43 110.289 175.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 41.3 mm -78.43 -37.82 22.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.249 0.547 . . . . 1.69 109.642 175.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -76.51 4.26 9.57 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.667 0.746 . . . . 1.36 110.486 175.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 539' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' B' ' 535' ' ' SER . 30.7 t70 -89.4 -46.94 8.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.104 -0.953 . . . . 1.23 109.17 173.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 42.0 mtm -60.33 -32.96 71.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.772 -1.103 . . . . 2.83 109.895 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 541' ' ' ASP . . . . . 0.425 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 2.2 t70 -55.13 -47.15 75.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.394 -0.821 . . . . 1.18 109.852 173.357 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 542' ' ' PHE . . . . . 0.41 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.1 OUTLIER -68.76 -35.12 76.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.241 -0.89 . . . . 0.66 110.988 -175.834 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 25.9 t -61.48 -36.65 81.06 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.181 -0.463 . . . . 2.08 110.197 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -84.68 -8.61 58.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.064 -0.516 . . . . 1.34 111.077 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 545' ' ' LEU . . . . . 0.562 ' O ' ' HG3' ' B' ' 548' ' ' GLN . 61.8 mt -88.27 -42.36 12.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.878 0.37 . . . . 1.82 111.811 178.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 25.9 mt -74.38 -26.0 59.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.65 0.738 . . . . 1.54 109.368 176.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 15.4 t -121.37 70.68 0.94 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.678 -1.146 . . . . 1.92 109.739 176.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 548' ' ' GLN . . . . . 0.562 ' HG3' ' O ' ' B' ' 545' ' ' LEU . 49.1 mt-30 -83.66 45.57 1.08 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.076 -0.511 . . . . 3.31 110.866 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 22.5 mt 54.24 60.84 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-O 121.667 0.746 . . . . 5.68 109.628 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 23.3 t -142.8 74.31 1.44 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.438 -0.801 . . . . 6.4 109.826 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.275 -0.869 . . . . 7.59 110.097 179.711 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.564 ' HA ' HD12 ' A' ' 18' ' ' ILE . 76.5 m80 . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 112.217 0.451 . . . . 0.75 112.217 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.1 p -147.77 161.59 40.94 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 119.807 -0.757 . . . . 1.0900000000000001 112.212 -177.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.45 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -177.82 -166.21 34.01 Favored Glycine 0 N--CA 1.44 -1.063 0 CA-C-N 114.803 -1.089 . . . . 0.16 110.413 -178.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.16 132.98 44.08 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 117.432 0.616 . . . . 0.16 110.241 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.482 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -144.58 145.51 31.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.952 0.406 . . . . 0.11 111.578 -176.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.468 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 84.4 mt -110.84 111.05 34.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.26 -0.427 . . . . 0.33000000000000002 110.246 178.357 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -112.51 137.33 50.89 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.714 -0.847 . . . . 0.35999999999999999 108.714 -178.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 57.1 23.28 8.31 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.966 0.412 . . . . 0.80000000000000004 110.479 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt 68.6 6.48 5.48 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.237 -0.892 . . . . 2.1099999999999999 112.741 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.401 HG13 ' CH2' ' A' ' 29' ' ' TRP . 1.5 p -94.04 122.16 45.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 108.025 -1.102 . . . . 0.22 108.025 166.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.9 p -76.21 142.49 41.47 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.896 0.379 . . . . 1.0700000000000001 111.293 -173.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.463 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -160.72 -157.72 8.88 Favored Glycine 0 N--CA 1.437 -1.282 0 C-N-CA 120.325 -0.941 . . . . 0.11 113.083 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 24.6 mm -126.66 135.58 63.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.095 -0.706 . . . . 0.13 109.095 -178.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.532 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.27 135.84 40.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.972 -0.381 . . . . 0.13 109.972 -176.428 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.98 126.71 25.5 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.846 0.355 . . . . 0.10000000000000001 111.642 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.564 HD12 ' HA ' ' A' ' 3' ' ' HIS . 71.0 mt -85.24 134.38 27.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.023 0.439 . . . . 0.27000000000000002 109.988 177.598 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -105.49 102.22 11.7 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.806 -0.633 . . . . 1.24 110.847 -175.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 23.9 mt-10 -116.66 169.68 9.17 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.166 -0.679 . . . . 1.2 109.166 174.625 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 26.6 t0 77.5 -1.32 2.71 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.474 1.131 . . . . 0.57999999999999996 109.513 -175.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 23' ' ' SER . 30.0 m -104.56 -174.67 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 113.762 -1.563 . . . . 0.25 109.766 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.618 ' O ' HG23 ' A' ' 22' ' ' VAL . 43.1 m -73.59 169.46 18.34 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 105.46 -2.052 . . . . 1.1299999999999999 105.46 174.318 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo -41.77 128.62 3.83 Favored 'Trans proline' 0 C--N 1.359 1.08 0 CA-C-N 121.624 1.616 . . . . 0.16 112.095 -143.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.483 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -55.77 143.1 32.17 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 114.194 -1.367 . . . . 0.10000000000000001 112.198 -161.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.99 167.83 14.77 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 114.715 -1.129 . . . . 0.32000000000000001 111.92 -170.408 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.66 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -118.09 107.86 14.51 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.627 -1.249 . . . . 0.089999999999999997 107.627 175.381 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 m -102.97 106.5 17.04 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.772 0.32 . . . . 0.17000000000000001 110.875 -175.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.401 ' CH2' HG13 ' A' ' 12' ' ' VAL . 84.4 t90 -87.16 131.8 34.06 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.888 -0.782 . . . . 0.14000000000000001 108.888 171.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.466 ' HG2' HG23 ' A' ' 37' ' ' VAL . 60.0 mtt180 -126.36 157.88 37.31 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.918 -0.771 . . . . 1.9099999999999999 108.918 174.294 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -67.12 172.79 4.26 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.184 -0.673 . . . . 0.59999999999999998 109.184 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.463 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.2 p -57.59 -32.36 67.09 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.323 -0.551 . . . . 0.26000000000000001 111.242 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -93.58 -32.18 14.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.581 0.705 . . . . 2.1200000000000001 109.546 172.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.443 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 99.59 17.39 26.36 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 114.921 -1.036 . . . . 0.23000000000000001 112.693 177.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.82 -29.37 66.63 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.269 0.557 . . . . 1.73 109.743 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -103.1 141.2 36.24 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.536 -0.912 . . . . 1.3 108.536 173.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.466 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.0 p -149.98 140.39 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.719 -0.392 . . . . 0.17000000000000001 111.489 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -144.47 125.45 14.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.435 . . . . 0.40999999999999998 109.969 177.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 26.4 m -111.21 133.48 53.52 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 111.876 0.324 . . . . 0.14999999999999999 111.876 -175.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.66 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.08 127.73 58.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.297 -1.001 . . . . 0.12 108.297 168.996 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.2 t -92.25 119.19 39.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 O-C-N 121.11 -0.994 . . . . 0.11 108.863 173.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.612 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.28 -16.58 64.01 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.433 0.531 . . . . 0.080000000000000002 112.433 -170.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.557 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 92.9 p -70.03 -14.8 62.85 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.32 -0.622 . . . . 0.87 109.32 175.511 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.3 p -112.76 11.13 19.33 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.103 -0.953 . . . . 0.14999999999999999 110.188 -178.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.544 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 26.7 mm -108.13 139.84 28.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.5 -0.555 . . . . 0.12 109.5 178.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -102.13 -43.83 5.62 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.194 -0.457 . . . . 0.52000000000000002 110.604 -177.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.1 mtmm -139.58 171.75 13.79 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.069 0.461 . . . . 1.4099999999999999 110.867 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.728 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -150.31 151.95 33.71 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.383 -0.969 . . . . 0.72999999999999998 108.383 178.482 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.487 ' HG3' HD11 ' A' ' 63' ' ' ILE . 2.3 mt-30 -139.02 145.98 40.3 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 109.777 -0.453 . . . . 1.9399999999999999 109.777 -177.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.537 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -137.74 132.81 33.32 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 122.09 -0.381 . . . . 0.22 110.24 174.726 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.471 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 64.1 p -60.18 118.62 34.85 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.74 -0.664 . . . . 0.26000000000000001 110.803 -176.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.451 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 24.6 Cg_exo -54.61 159.75 8.25 Favored 'Trans proline' 0 N--CA 1.464 -0.214 0 C-N-CA 122.776 2.318 . . . . 0.38 112.191 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.82 -21.27 66.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.011 -0.54 . . . . 0.66000000000000003 111.007 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.2 p -83.42 -16.72 44.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.964 -0.562 . . . . 1.5 111.05 176.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.451 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 56.0 m -77.3 134.77 38.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.919 -0.582 . . . . 0.84999999999999998 111.323 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -56.53 -32.84 65.49 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 114.999 -1.0 . . . . 1.77 110.11 172.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.459 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 35.7 mmtm -75.62 151.67 37.77 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.367 -1.288 . . . . 1.6299999999999999 111.471 -176.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.471 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 5.3 mtp -131.31 98.76 4.63 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.257 -0.883 . . . . 1.1100000000000001 109.454 169.509 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.462 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.3 OUTLIER -158.02 158.06 34.13 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.485 -0.78 . . . . 0.22 111.38 -171.613 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.567 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -133.31 119.6 19.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.873 -1.058 . . . . 0.10000000000000001 108.2 176.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.591 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.8 mtp180 -103.13 145.68 29.55 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.273 0.559 . . . . 2.9900000000000002 111.476 -178.233 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.947 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -127.76 107.37 9.83 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.919 -1.037 . . . . 0.13 108.992 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.512 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.3 mp -88.49 103.8 14.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.745 0.307 . . . . 0.28999999999999998 110.826 -171.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.446 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -67.01 144.08 44.34 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.107 -0.497 . . . . 0.54000000000000004 112.164 178.216 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.544 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 84.6 mttt . . . . . 0 C--N 1.319 -0.739 0 N-CA-C 112.488 0.551 . . . . 0.55000000000000004 112.488 -176.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.859 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 10.4 t70 . . . . . 0 N--CA 1.446 -0.666 0 N-CA-C 109.107 -0.701 . . . . 3.23 109.107 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -87.52 -2.62 58.74 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.021 0.378 . . . . 2.3900000000000001 112.021 -175.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.2 p -68.76 -18.24 64.18 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.573 0.701 . . . . 2.96 109.612 175.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.859 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 2.7 ptpp? -84.16 35.3 0.53 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.196 -0.911 . . . . 2.4900000000000002 110.943 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -45.16 115.07 0.83 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.413 0.625 . . . . 3.3999999999999999 110.139 -176.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.55 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 78.1 ttt180 -90.48 159.25 16.62 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.884 -1.053 . . . . 3.7999999999999998 108.664 -171.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mtpt -124.74 131.34 53.46 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 119.824 -0.75 . . . . 4.29 110.637 174.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.9 167.5 4.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.765 -1.107 . . . . 4.4100000000000001 110.692 177.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -55.15 -32.86 62.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.756 0.312 . . . . 5.3399999999999999 111.31 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -86.98 11.98 12.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.962 0.411 . . . . 5.3799999999999999 111.537 179.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.17 32.0 65.95 Favored Glycine 0 N--CA 1.452 -0.287 0 CA-C-N 115.972 -0.558 . . . . 4.3700000000000001 113.051 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -89.52 130.61 35.82 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.23 -0.656 . . . . 4.5099999999999998 109.23 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -64.51 104.2 0.76 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.569 -0.53 . . . . 4.2800000000000002 109.569 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.55 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 7.4 m -120.63 97.91 5.56 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 122.022 0.915 . . . . 3.1000000000000001 109.518 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.446 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 p -90.42 126.71 55.55 Favored Pre-proline 0 C--N 1.31 -1.13 0 CA-C-N 115.339 -0.846 . . . . 2.5 110.195 -175.067 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.45 ' HG2' ' CD ' ' A' ' 70' ' ' LYS . 78.4 Cg_exo . . . . . 0 C--N 1.348 0.51 0 C-N-CA 122.993 2.462 . . . . 1.8700000000000001 112.449 -176.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.556 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 82.0 m-70 . . . . . 0 N--CA 1.447 -0.598 0 N-CA-C 107.088 -1.449 . . . . 0.71999999999999997 107.088 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.591 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 19.9 ttm -140.99 124.21 16.52 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 118.904 0.775 . . . . 0.27000000000000002 111.067 176.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.482 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.4 m-85 -113.94 128.17 56.28 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.227 -0.897 . . . . 0.27000000000000002 109.641 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.468 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -80.4 152.27 28.94 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.925 -0.398 . . . . 1.26 109.925 177.732 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.453 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 19.9 m-85 -133.55 171.94 13.42 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.298 0.571 . . . . 0.32000000000000001 111.835 -173.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -122.73 -8.03 8.48 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.035 -0.984 . . . . 2.3799999999999999 110.894 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -146.01 128.31 15.81 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.213 0.53 . . . . 1.1000000000000001 110.777 -176.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.443 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 8.6 mmm180 -63.24 -38.58 91.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.105 -0.952 . . . . 3.0899999999999999 112.183 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.419 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 86.8 m -60.98 -36.3 79.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.816 0.341 . . . . 0.34999999999999998 110.739 -178.17 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.617 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.0 t -67.41 -55.17 18.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.367 -0.379 . . . . 0.23000000000000001 110.471 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.567 ' HA ' HD12 ' A' ' 60' ' ' LEU . 12.3 ptp -60.39 -36.54 78.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 0.17000000000000001 111.128 -176.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 102' ' ' MET . 23.2 t70 -66.96 -42.96 84.29 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.544 -0.463 . . . . 0.34000000000000002 110.132 177.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.454 ' O ' ' HB3' ' A' ' 102' ' ' MET . 1.5 t-20 -67.2 -44.95 78.33 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.437 0.46 . . . . 1.3600000000000001 111.185 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.617 HG12 ' O ' ' A' ' 96' ' ' VAL . 33.6 mm -61.44 -56.36 18.32 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 109.412 -0.588 . . . . 0.12 109.412 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.871 ' HA ' HD12 ' A' ' 104' ' ' LEU . 18.9 ttpp -52.72 -44.57 66.44 Favored 'General case' 0 C--O 1.216 -0.678 0 O-C-N 123.529 0.518 . . . . 0.79000000000000004 110.028 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.516 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 40.1 ttp -51.34 -54.17 28.93 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.075 -0.966 . . . . 0.28000000000000003 111.24 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.754 ' O ' HG13 ' A' ' 107' ' ' ILE . 99.0 m -62.94 -51.31 67.41 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.419 -0.355 . . . . 0.17999999999999999 110.877 178.036 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.947 HD13 HD21 ' A' ' 62' ' ' LEU . 29.5 mt -46.68 -53.52 11.51 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.728 0.775 . . . . 0.089999999999999997 110.514 175.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.6 ' CG ' HD13 ' A' ' 48' ' ' LEU . 23.0 mt-30 -54.84 -41.96 71.36 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.366 -1.288 . . . . 1.2 112.345 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' A' ' 102' ' ' MET . 14.7 mm100 -64.19 -33.65 76.29 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.915 0.864 . . . . 2.3700000000000001 109.841 178.078 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.754 HG13 ' O ' ' A' ' 103' ' ' THR . 14.9 mt -76.59 -46.16 31.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.25 -1.341 . . . . 0.14999999999999999 111.426 -177.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.728 HD12 HD11 ' A' ' 48' ' ' LEU . 8.8 mt -62.31 -41.39 91.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.312 -0.404 . . . . 0.19 111.976 -176.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.427 ' HA ' ' HB2' ' A' ' 112' ' ' LYS . 33.1 t -57.79 -25.58 60.75 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.711 0.291 . . . . 1.1399999999999999 111.028 -177.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 76.9 mtt180 -64.78 -39.8 94.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.368 0.604 . . . . 1.6399999999999999 109.879 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.557 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 32.5 m-85 -93.84 -10.17 34.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.545 -0.752 . . . . 0.65000000000000002 110.193 -179.115 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.427 ' HB2' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.605 0 N-CA-C 108.523 -0.917 . . . . 0.76000000000000001 108.523 174.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.406 ' CD2' HG21 ' A' ' 103' ' ' THR . 68.6 m80 . . . . . 0 N--CA 1.469 0.496 0 N-CA-C 112.881 0.696 . . . . 0.75 112.881 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 p -146.53 167.24 24.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.647 0.737 . . . . 1.0900000000000001 112.962 -172.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.49 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 176.01 -165.97 36.86 Favored Glycine 0 N--CA 1.445 -0.761 0 CA-C-N 114.511 -1.222 . . . . 0.16 110.049 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.81 135.69 38.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 118.017 0.908 . . . . 0.16 110.461 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.54 146.71 32.51 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.014 0.435 . . . . 0.11 111.111 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.569 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 52.2 mt -110.38 111.06 34.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.911 -0.586 . . . . 0.33000000000000002 110.054 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -112.57 132.32 55.18 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 108.598 -0.89 . . . . 0.35999999999999999 108.598 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 58.51 25.2 12.76 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 120.962 0.411 . . . . 0.80000000000000004 110.539 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.7 mtpt 68.98 4.12 4.36 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.551 -0.75 . . . . 2.1099999999999999 112.901 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.404 ' O ' ' HZ2' ' A' ' 29' ' ' TRP . 1.2 p -92.37 115.25 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 107.697 -1.224 . . . . 0.22 107.697 166.465 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.0 m -71.92 145.75 48.28 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.057 -0.52 . . . . 1.0700000000000001 110.82 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.73 -158.76 10.57 Favored Glycine 0 N--CA 1.433 -1.538 0 C-N-CA 119.914 -1.136 . . . . 0.11 113.196 -177.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.7 mm -126.18 132.03 70.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 109.336 -0.616 . . . . 0.13 109.336 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.502 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -100.49 134.93 38.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.721 -0.474 . . . . 0.13 109.721 -177.559 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.11 128.18 27.7 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.416 -0.356 . . . . 0.10000000000000001 111.054 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.2 mt -85.1 138.07 19.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.387 0.613 . . . . 0.27000000000000002 109.932 175.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -106.93 99.4 8.97 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 114.808 -1.087 . . . . 1.24 110.299 -176.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -113.97 169.71 8.8 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.317 -0.623 . . . . 1.2 109.317 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.2 t70 76.16 -2.1 2.81 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 122.107 0.956 . . . . 0.57999999999999996 109.857 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 23' ' ' SER . 34.6 m -103.2 -173.59 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.156 -1.384 . . . . 0.25 109.742 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.629 ' O ' HG23 ' A' ' 22' ' ' VAL . 28.4 m -72.68 167.31 34.57 Favored Pre-proline 0 C--N 1.318 -0.79 0 N-CA-C 105.065 -2.198 . . . . 1.1299999999999999 105.065 173.088 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -42.09 127.71 3.99 Favored 'Trans proline' 0 C--N 1.355 0.896 0 CA-C-N 121.279 1.492 . . . . 0.16 112.412 -140.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -50.53 138.57 17.34 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 113.942 -1.481 . . . . 0.10000000000000001 112.399 -166.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -123.39 168.77 12.1 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 114.259 -1.337 . . . . 0.32000000000000001 111.817 -170.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.72 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.15 106.5 13.4 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.324 -1.361 . . . . 0.089999999999999997 107.324 172.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.3 m -102.52 106.22 16.89 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 120.887 0.375 . . . . 0.17000000000000001 110.785 -176.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.404 ' HZ2' ' O ' ' A' ' 12' ' ' VAL . 81.5 t90 -85.24 132.14 34.32 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.781 -0.822 . . . . 0.14000000000000001 108.781 172.391 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.464 ' HG2' HG23 ' A' ' 37' ' ' VAL . 57.1 mtt180 -125.84 158.27 35.46 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.023 -0.732 . . . . 1.9099999999999999 109.023 174.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.2 p -69.84 175.99 3.96 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 109.305 -0.628 . . . . 0.59999999999999998 109.305 178.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 p -59.89 -38.3 81.85 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.231 -0.588 . . . . 0.26000000000000001 111.034 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.0 -29.89 24.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.776 0.798 . . . . 2.1200000000000001 109.36 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.426 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 94.66 16.41 42.56 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 114.737 -1.12 . . . . 0.23000000000000001 112.331 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -69.11 -40.07 78.57 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.433 -0.58 . . . . 1.73 109.433 176.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -87.89 139.42 30.53 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.799 -0.815 . . . . 1.3 108.799 171.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.464 HG23 ' HG2' ' A' ' 30' ' ' ARG . 13.6 p -149.1 137.86 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.811 0.338 . . . . 0.17000000000000001 110.828 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -144.5 123.16 12.54 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.756 -0.461 . . . . 0.40999999999999998 109.756 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 49.2 m -112.81 131.94 55.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.732 0.641 . . . . 0.14999999999999999 112.732 -174.045 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.72 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -99.31 131.03 47.38 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.597 0 N-CA-C 108.035 -1.098 . . . . 0.12 108.035 168.259 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.418 ' O ' HG12 ' A' ' 45' ' ' ILE . 63.9 t -93.86 121.38 44.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 O-C-N 121.122 -0.986 . . . . 0.11 108.843 171.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.61 -19.77 64.46 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.157 0.799 . . . . 0.080000000000000002 113.157 -169.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.3 p -69.43 -14.44 62.89 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.05 -0.66 . . . . 0.87 109.681 175.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -109.62 10.54 24.96 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.599 -0.728 . . . . 0.14999999999999999 110.076 -178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.533 HG21 ' CD1' ' A' ' 62' ' ' LEU . 24.6 mm -111.48 141.09 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 108.871 -0.788 . . . . 0.12 108.871 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -106.91 -43.67 4.6 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.908 0.385 . . . . 0.52000000000000002 110.636 -177.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.455 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 1.0 OUTLIER -134.31 165.81 24.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.042 -0.526 . . . . 1.4099999999999999 110.744 -174.822 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.78 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -150.32 132.35 15.26 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.706 -0.85 . . . . 0.72999999999999998 108.706 177.816 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -134.91 123.11 22.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.969 -0.382 . . . . 1.9399999999999999 109.969 -172.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -115.93 143.15 45.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.321 0.509 . . . . 0.22 110.907 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.622 HG21 ' HB3' ' A' ' 57' ' ' LYS . 62.0 p -61.73 120.78 59.72 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 115.884 -0.598 . . . . 0.26000000000000001 110.859 -177.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.423 ' HD2' ' HB3' ' A' ' 55' ' ' SER . 24.6 Cg_exo -55.29 157.11 15.0 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.556 2.17 . . . . 0.38 111.445 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.23 -9.03 14.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.854 0.359 . . . . 0.66000000000000003 111.854 -177.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.9 p -104.76 -9.46 18.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 1.5 111.829 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.596 ' OG ' ' HB ' ' A' ' 51' ' ' THR . 89.5 p -64.83 151.89 44.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.062 0.458 . . . . 0.84999999999999998 111.092 -178.262 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.502 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 65.4 mt-10 -59.2 -22.7 61.43 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.823 0.82 . . . . 1.77 110.231 171.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.622 ' HB3' HG21 ' A' ' 51' ' ' THR . 9.9 mptt -101.43 169.42 8.88 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 114.27 -1.332 . . . . 1.6299999999999999 112.838 -170.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.448 ' O ' ' HG3' ' A' ' 59' ' ' MET . 65.7 mmm -141.44 98.34 3.34 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.474 -1.239 . . . . 1.1100000000000001 108.109 165.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.455 ' CE ' ' HG2' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -157.52 160.31 38.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.685 -0.689 . . . . 0.22 111.346 -169.733 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.536 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -131.99 120.38 22.37 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.046 -0.979 . . . . 0.10000000000000001 108.481 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.525 ' HD3' ' CB ' ' A' ' 88' ' ' MET . 3.6 mmt85 -99.95 131.62 45.8 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 120.992 0.425 . . . . 2.9900000000000002 110.37 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.943 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -112.84 106.44 14.76 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.563 -0.744 . . . . 0.13 109.0 175.124 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 4.7 mp -92.32 105.7 16.97 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 120.955 0.407 . . . . 0.28999999999999998 111.163 -171.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -63.04 164.36 28.29 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.356 -0.838 . . . . 0.54000000000000004 112.626 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.404 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.7 mttt . . . . . 0 C--N 1.316 -0.881 0 CA-C-O 121.567 0.699 . . . . 0.55000000000000004 112.567 -176.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.803 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 22.1 t70 . . . . . 0 C--O 1.215 -0.719 0 N-CA-C 109.292 -0.632 . . . . 3.23 109.292 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.4 -2.65 6.58 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.109 0.411 . . . . 2.3900000000000001 112.109 -172.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.9 p -80.18 -0.99 38.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.934 0.397 . . . . 2.96 110.716 171.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.803 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.4 ptpt -86.85 39.05 0.83 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.112 -0.495 . . . . 2.4900000000000002 110.154 173.59 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.532 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 24.7 mmtm -43.71 113.81 0.56 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.982 -0.554 . . . . 3.3999999999999999 110.366 -175.022 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.649 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 56.8 ttt180 -90.71 161.53 15.31 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.075 -1.083 . . . . 3.7999999999999998 108.075 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 95.7 mttt -135.29 144.97 47.06 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 118.188 0.449 . . . . 4.29 110.053 175.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.453 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER -78.88 179.92 6.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.933 -0.576 . . . . 4.4100000000000001 109.559 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -56.33 -29.76 61.73 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 111.913 0.338 . . . . 5.3399999999999999 111.913 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.453 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 17.6 mt-10 -81.22 -40.83 23.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.855 0.359 . . . . 5.3799999999999999 110.83 -178.638 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.22 15.47 2.05 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.427 -0.892 . . . . 4.3700000000000001 112.835 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.538 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 41.0 m-80 -74.04 132.07 41.98 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.664 -0.495 . . . . 4.5099999999999998 109.664 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -74.48 92.93 2.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.127 0.489 . . . . 4.2800000000000002 110.028 -178.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.649 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 7.5 m -102.65 99.46 8.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.833 0.825 . . . . 3.1000000000000001 109.227 -179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.532 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.85 125.57 62.25 Favored Pre-proline 0 C--N 1.312 -1.051 0 CA-C-N 115.886 -0.597 . . . . 2.5 110.492 -176.279 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo . . . . . 0 N--CA 1.459 -0.543 0 C-N-CA 122.852 2.368 . . . . 1.8700000000000001 111.998 179.813 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.471 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 50.9 m80 . . . . . 0 C--O 1.219 -0.517 0 N-CA-C 109.348 -0.612 . . . . 0.71999999999999997 109.348 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.525 ' CB ' ' HD3' ' A' ' 61' ' ' ARG . 23.2 ttm -101.92 132.82 47.49 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.374 -0.53 . . . . 0.27000000000000002 111.261 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -121.66 129.64 52.92 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.252 -0.648 . . . . 0.27000000000000002 109.252 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.569 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -80.69 153.6 27.79 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 120.943 0.401 . . . . 1.26 110.186 176.687 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.499 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 21.2 m-85 -135.75 166.07 24.12 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.298 0.571 . . . . 0.32000000000000001 111.195 -175.17 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -114.61 -19.32 11.16 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.198 -0.91 . . . . 2.3799999999999999 109.869 176.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.549 ' HB2' HG23 ' A' ' 96' ' ' VAL . 18.7 m120 -134.89 123.66 23.79 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.884 -0.598 . . . . 1.1000000000000001 110.788 -174.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.53 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 14.6 mmm180 -63.04 -34.25 77.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.337 -0.847 . . . . 3.0899999999999999 112.236 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.4 m -62.16 -34.62 76.74 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.955 0.407 . . . . 0.34999999999999998 110.777 -178.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.571 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.2 t -70.13 -58.01 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-N 116.03 -0.532 . . . . 0.23000000000000001 110.265 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.536 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.3 ptp -55.32 -38.42 68.69 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.15 -0.477 . . . . 0.17000000000000001 111.052 -177.377 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.429 ' N ' ' HG3' ' A' ' 97' ' ' MET . 30.1 t70 -63.9 -45.65 88.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.647 0.261 . . . . 0.34000000000000002 110.448 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -71.69 -35.25 70.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.088 -0.505 . . . . 1.3600000000000001 111.887 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.663 HG22 HD11 ' A' ' 104' ' ' LEU . 28.2 mm -66.95 -57.47 9.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 108.472 -0.936 . . . . 0.12 108.472 175.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.773 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.7 ttpt -48.0 -50.39 27.7 Favored 'General case' 0 C--O 1.219 -0.522 0 O-C-N 124.223 0.952 . . . . 0.79000000000000004 109.899 176.393 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.693 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 48.1 ttp -48.19 -57.55 5.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.227 -0.897 . . . . 0.28000000000000003 111.2 177.522 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.729 ' O ' HG13 ' A' ' 107' ' ' ILE . 45.1 m -58.45 -53.77 54.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.413 -0.358 . . . . 0.17999999999999999 110.73 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.943 HD13 HD21 ' A' ' 62' ' ' LEU . 22.7 mt -47.21 -53.77 12.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.492 0.663 . . . . 0.089999999999999997 110.561 176.054 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.661 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.7 mt-30 -53.66 -42.04 67.45 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.611 -1.177 . . . . 1.2 112.372 176.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.693 ' HG3' ' O ' ' A' ' 102' ' ' MET . 36.5 mt-30 -66.03 -31.65 72.67 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.782 0.801 . . . . 2.3700000000000001 109.194 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.729 HG13 ' O ' ' A' ' 103' ' ' THR . 15.0 mt -77.35 -45.1 29.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 114.597 -1.183 . . . . 0.14999999999999999 111.289 -177.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.78 HD12 HD11 ' A' ' 48' ' ' LEU . 9.8 mt -65.24 -38.45 82.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.166 -0.47 . . . . 0.19 112.177 -175.682 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.401 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 3.8 p -59.54 -26.49 65.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.878 0.37 . . . . 1.1399999999999999 110.986 -179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -60.63 -50.58 72.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.79 0.805 . . . . 1.6399999999999999 109.478 173.255 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -89.96 28.31 1.4 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.71 -1.132 . . . . 0.65000000000000002 110.1 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 112' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.714 0 N-CA-C 108.036 -1.098 . . . . 0.76000000000000001 108.036 174.24 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.558 ' CD2' HG21 ' A' ' 103' ' ' THR . 73.7 m80 . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 112.033 0.383 . . . . 0.75 112.033 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.9 p -157.25 155.7 31.24 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 119.943 -0.703 . . . . 1.0900000000000001 112.318 -174.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.516 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -173.76 -162.17 25.14 Favored Glycine 0 N--CA 1.439 -1.124 0 CA-C-N 114.627 -1.169 . . . . 0.16 110.438 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -101.39 136.02 41.93 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 117.345 0.573 . . . . 0.16 110.162 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.5 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -147.45 141.15 25.63 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.988 0.423 . . . . 0.11 111.876 -176.028 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.479 HG12 ' HA ' ' A' ' 13' ' ' SER . 88.0 mt -105.58 122.26 58.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.147 -0.479 . . . . 0.33000000000000002 109.937 175.411 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -127.79 131.2 49.62 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.723 -0.843 . . . . 0.35999999999999999 108.723 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 60.28 29.62 19.16 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.909 0.484 . . . . 0.80000000000000004 110.562 -177.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm 65.72 5.78 3.54 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.921 0.711 . . . . 2.1099999999999999 112.921 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 p -98.49 119.91 47.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.476 -0.935 . . . . 0.22 108.476 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.479 ' HA ' HG12 ' A' ' 8' ' ' ILE . 52.5 p -74.34 144.71 44.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.158 -0.474 . . . . 1.0700000000000001 110.904 -175.038 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.422 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.81 -159.57 10.26 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.258 -0.972 . . . . 0.11 113.286 -178.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 19.9 mm -125.93 134.73 65.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 109.107 -0.701 . . . . 0.13 109.107 -178.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.554 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.22 135.7 37.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 110.129 -0.323 . . . . 0.13 110.129 -176.572 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.59 129.03 30.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.985 0.421 . . . . 0.10000000000000001 111.413 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.546 HD12 ' HA ' ' A' ' 3' ' ' HIS . 61.9 mt -85.91 135.37 25.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 109.763 -0.458 . . . . 0.27000000000000002 109.763 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -108.67 103.28 12.35 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.096 -0.502 . . . . 1.24 111.182 -173.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 28.2 mt-10 -116.79 170.75 8.36 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.46 -0.941 . . . . 1.2 108.46 174.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.456 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.8 t70 81.07 -5.97 1.63 Allowed 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 122.428 1.109 . . . . 0.57999999999999996 109.361 -176.297 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 23' ' ' SER . 32.7 m -103.33 -174.17 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 CA-C-N 113.753 -1.567 . . . . 0.25 109.943 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.662 ' O ' HG23 ' A' ' 22' ' ' VAL . 57.9 m -73.14 168.67 22.75 Favored Pre-proline 0 C--N 1.313 -1.001 0 N-CA-C 105.423 -2.066 . . . . 1.1299999999999999 105.423 173.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -41.31 128.13 3.16 Favored 'Trans proline' 0 C--N 1.355 0.885 0 CA-C-N 121.296 1.499 . . . . 0.16 112.642 -143.041 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.488 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -51.44 141.7 15.14 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 113.993 -1.458 . . . . 0.10000000000000001 112.563 -165.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.65 168.79 12.67 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 114.228 -1.351 . . . . 0.32000000000000001 111.922 -170.209 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -116.53 107.3 14.57 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.398 -1.334 . . . . 0.089999999999999997 107.398 172.173 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.6 m -104.49 106.7 17.3 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 120.878 0.371 . . . . 0.17000000000000001 110.894 -175.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.7 t90 -85.12 132.34 34.32 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.842 -0.799 . . . . 0.14000000000000001 108.842 172.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HG2' HG23 ' A' ' 37' ' ' VAL . 62.1 mtt180 -127.29 156.97 41.09 Favored 'General case' 0 C--N 1.31 -1.122 0 N-CA-C 108.893 -0.781 . . . . 1.9099999999999999 108.893 174.515 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -68.76 176.04 3.25 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.385 -0.598 . . . . 0.59999999999999998 109.385 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.422 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 9.3 p -60.13 -40.79 91.02 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.162 -0.615 . . . . 0.26000000000000001 110.421 178.304 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -76.73 -31.33 57.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.85 0.833 . . . . 2.1200000000000001 109.157 170.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.458 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 89.63 15.27 58.55 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 114.458 -1.247 . . . . 0.23000000000000001 111.813 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -64.36 -53.37 49.7 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.288 -0.634 . . . . 1.73 109.288 174.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.0 tttt -76.76 139.28 40.36 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.328 -0.851 . . . . 1.3 108.878 174.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.5 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.4 p -149.43 138.81 15.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.927 0.394 . . . . 0.17000000000000001 111.142 -178.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -144.18 126.21 15.45 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.751 -0.463 . . . . 0.40999999999999998 109.751 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 30.0 m -114.7 133.22 56.05 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.396 0.517 . . . . 0.14999999999999999 112.396 -173.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -101.74 130.05 52.0 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.592 0 N-CA-C 108.125 -1.065 . . . . 0.12 108.125 168.482 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.404 ' O ' HG12 ' A' ' 45' ' ' ILE . 63.3 t -93.72 121.93 44.77 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 O-C-N 121.194 -0.941 . . . . 0.11 108.801 173.017 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.594 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.35 -18.45 63.8 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.136 0.791 . . . . 0.080000000000000002 113.136 -169.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.6 p -69.55 -15.47 63.23 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.922 -0.711 . . . . 0.87 109.562 174.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 p -109.84 12.2 24.03 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.464 -0.789 . . . . 0.14999999999999999 110.013 -178.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.552 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.9 mm -111.54 138.91 38.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.991 -0.549 . . . . 0.12 109.659 178.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -100.1 -46.66 5.25 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.824 -0.625 . . . . 0.52000000000000002 110.563 -177.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.493 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 18.1 mtmt -140.3 174.73 10.22 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.135 0.493 . . . . 1.4099999999999999 111.442 -176.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.616 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -152.73 136.07 15.84 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.748 -0.834 . . . . 0.72999999999999998 108.748 -179.35 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.557 ' HG2' HD11 ' A' ' 63' ' ' ILE . 6.8 mm100 -129.81 122.53 28.94 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 122.282 -0.261 . . . . 1.9399999999999999 110.463 -175.197 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.455 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -116.09 140.97 48.74 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 122.052 -0.405 . . . . 0.22 111.279 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 66.6 p -66.97 119.3 63.03 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-N 116.099 -0.5 . . . . 0.26000000000000001 110.146 -177.409 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.459 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 26.0 Cg_exo -54.25 159.91 7.28 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 122.721 2.28 . . . . 0.38 111.556 178.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.89 -15.69 63.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.195 -0.457 . . . . 0.66000000000000003 110.573 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -86.14 -16.82 36.71 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 1.5 110.595 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.459 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 47.4 m -76.79 140.7 40.81 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.845 -0.616 . . . . 0.84999999999999998 111.019 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -66.56 -18.68 65.5 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.404 -0.817 . . . . 1.77 110.7 176.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.575 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 11.2 mmmm -87.05 151.14 23.5 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.743 -1.117 . . . . 1.6299999999999999 111.031 -175.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -124.93 96.57 4.92 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 108.121 -1.066 . . . . 1.1100000000000001 108.121 169.139 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.575 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.23 155.96 34.77 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.458 0.647 . . . . 0.22 111.899 -174.499 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.606 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -134.36 119.25 18.4 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.698 -1.137 . . . . 0.10000000000000001 108.329 175.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.727 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 3.5 mtp180 -102.42 142.78 33.08 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.249 0.547 . . . . 2.9900000000000002 111.311 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.942 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -121.53 107.81 12.87 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.036 -0.984 . . . . 0.13 109.012 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.565 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.7 mp -90.81 103.67 14.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.773 -0.455 . . . . 0.28999999999999998 109.773 -172.068 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.431 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -67.54 151.89 52.39 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 121.394 -0.432 . . . . 0.54000000000000004 112.885 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.498 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 83.8 mttt . . . . . 0 C--N 1.322 -0.606 0 C-N-CA 122.655 0.382 . . . . 0.55000000000000004 111.182 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.577 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.3 m-20 . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 107.993 -1.114 . . . . 3.23 107.993 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.68 -1.79 4.18 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.31 0.485 . . . . 2.3900000000000001 112.31 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.2 p -69.21 -11.26 60.65 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.35 0.595 . . . . 2.96 109.861 168.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -84.69 26.41 0.82 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.399 -0.819 . . . . 2.4900000000000002 111.382 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.7 mtmt -47.08 113.75 0.73 Allowed 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.432 0.634 . . . . 3.3999999999999999 109.332 -174.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.47 ' HB3' HG23 ' A' ' 80' ' ' VAL . 72.6 ttt180 -96.85 168.61 10.39 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.692 -1.14 . . . . 3.7999999999999998 109.069 -167.568 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 63.9 mttp -133.59 141.47 47.69 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 118.104 0.411 . . . . 4.29 110.185 174.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -82.11 -168.38 1.93 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.902 -0.59 . . . . 4.4100000000000001 110.695 -177.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -56.84 -31.11 64.45 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.799 0.296 . . . . 5.3399999999999999 111.799 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.448 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 10.6 mt-10 -86.86 -34.68 19.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.1 0.476 . . . . 5.3799999999999999 110.444 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.94 18.36 5.15 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.478 -0.868 . . . . 4.3700000000000001 112.049 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.551 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 30.8 m-80 -75.39 134.8 40.86 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.993 -0.744 . . . . 4.5099999999999998 108.993 177.557 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -69.02 92.68 0.53 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.982 0.42 . . . . 4.2800000000000002 110.235 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.47 HG23 ' HB3' ' A' ' 72' ' ' ARG . 19.0 m -97.22 99.58 9.16 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-O 121.677 0.751 . . . . 3.1000000000000001 109.574 176.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 1.5 p -85.4 107.38 12.0 Favored Pre-proline 0 C--N 1.317 -0.844 0 N-CA-C 109.354 -0.61 . . . . 2.5 109.354 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo . . . . . 0 C--O 1.234 0.301 0 C-N-CA 123.48 2.786 . . . . 1.8700000000000001 113.943 -170.868 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.557 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 62.5 m80 . . . . . 0 C--O 1.217 -0.613 0 N-CA-C 107.541 -1.281 . . . . 0.71999999999999997 107.541 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.727 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 22.9 ttm -140.97 132.35 26.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 119.135 0.88 . . . . 0.27000000000000002 111.265 173.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.5 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.6 m-85 -122.18 128.74 51.58 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.339 -0.846 . . . . 0.27000000000000002 109.588 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.477 ' O ' ' HA ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -81.65 150.57 28.01 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.943 -0.391 . . . . 1.26 109.943 177.251 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.427 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.1 m-85 -130.13 175.73 8.67 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.965 0.412 . . . . 0.32000000000000001 111.55 -173.525 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -122.57 -9.53 8.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.715 -0.675 . . . . 2.3799999999999999 110.494 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.51 ' HB2' HG23 ' A' ' 96' ' ' VAL . 52.6 m-80 -146.16 136.96 24.31 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.237 -0.438 . . . . 1.1000000000000001 110.087 -179.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.464 ' HD3' ' HE1' ' A' ' 58' ' ' MET . 1.2 mpp_? -70.5 -35.09 73.03 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.905 -0.589 . . . . 3.0899999999999999 111.544 -178.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.448 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 19.5 m -61.63 -36.34 80.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.801 0.334 . . . . 0.34999999999999998 110.578 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.615 ' O ' HG12 ' A' ' 100' ' ' ILE . 17.5 t -64.71 -58.2 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 116.203 -0.453 . . . . 0.23000000000000001 110.499 178.494 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.606 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.0 ptp -57.59 -39.1 76.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.17000000000000001 110.916 -177.257 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.407 ' N ' ' HG3' ' A' ' 97' ' ' MET . 19.5 t70 -65.66 -42.14 91.7 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.641 -0.424 . . . . 0.34000000000000002 110.208 177.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.448 ' HB2' ' O ' ' A' ' 95' ' ' THR . 1.6 t-20 -68.83 -43.97 74.42 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 123.27 0.356 . . . . 1.3600000000000001 111.351 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 96' ' ' VAL . 31.4 mm -61.8 -56.58 16.81 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 N-CA-C 108.674 -0.862 . . . . 0.12 108.674 177.641 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.803 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.8 ttpt -50.81 -48.6 59.67 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.9 0.75 . . . . 0.79000000000000004 109.864 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.685 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 44.2 ttp -49.35 -54.82 15.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.387 -0.824 . . . . 0.28000000000000003 111.321 177.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.696 ' O ' HG13 ' A' ' 107' ' ' ILE . 30.0 m -61.92 -51.96 66.0 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.322 -0.399 . . . . 0.17999999999999999 110.592 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.942 HD13 HD21 ' A' ' 62' ' ' LEU . 29.2 mt -46.48 -54.7 8.74 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.835 -0.62 . . . . 0.089999999999999997 110.17 174.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.558 ' CG ' HD13 ' A' ' 48' ' ' LEU . 90.8 mt-30 -52.17 -43.87 64.34 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.747 -1.115 . . . . 1.2 112.262 176.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.685 ' HG3' ' O ' ' A' ' 102' ' ' MET . 37.6 mt-30 -64.3 -40.65 96.37 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.952 0.882 . . . . 2.3700000000000001 108.966 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.696 HG13 ' O ' ' A' ' 103' ' ' THR . 7.8 mt -68.88 -42.22 82.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 114.29 -1.323 . . . . 0.14999999999999999 111.163 -178.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.616 HD12 HD11 ' A' ' 48' ' ' LEU . 7.2 mt -66.91 -37.64 79.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.413 -0.358 . . . . 0.19 111.471 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.4 t -59.58 -28.85 67.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.699 0.285 . . . . 1.1399999999999999 110.587 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -59.41 -53.6 56.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.281 -0.637 . . . . 1.6399999999999999 109.281 173.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -86.99 32.97 0.66 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.2 -0.909 . . . . 0.65000000000000002 110.265 176.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? . . . . . 0 C--N 1.317 -0.824 0 N-CA-C 107.384 -1.339 . . . . 0.76000000000000001 107.384 174.394 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.561 ' HA ' HD12 ' A' ' 18' ' ' ILE . 74.5 m80 . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 112.015 0.376 . . . . 0.75 112.015 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.1 p -154.27 163.19 40.52 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 119.817 -0.753 . . . . 1.0900000000000001 112.293 -176.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.529 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 177.0 -158.0 23.41 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 110.424 -1.07 . . . . 0.16 110.424 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.422 ' HA ' HD13 ' A' ' 15' ' ' ILE . . . -102.54 135.07 44.83 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 117.386 0.593 . . . . 0.16 110.472 179.511 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.522 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -147.26 142.74 27.53 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.274 -0.421 . . . . 0.11 111.247 -177.53 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.782 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 62.3 mt -101.72 126.46 55.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.993 -0.373 . . . . 0.33000000000000002 109.993 175.041 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.442 ' O ' HG13 ' A' ' 12' ' ' VAL . 21.2 t80 -129.51 129.92 45.14 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.581 -0.896 . . . . 0.35999999999999999 108.581 177.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 62.45 29.12 17.1 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 123.386 0.429 . . . . 0.80000000000000004 110.5 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm 68.52 -0.12 2.38 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.982 0.734 . . . . 2.1099999999999999 112.982 178.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.442 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.7 OUTLIER -92.86 116.86 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 108.228 -1.027 . . . . 0.22 108.228 166.915 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.5 p -73.24 142.27 47.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.29 -0.414 . . . . 1.0700000000000001 110.42 -176.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.493 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -158.42 -158.17 8.87 Favored Glycine 0 N--CA 1.438 -1.21 0 C-N-CA 119.835 -1.174 . . . . 0.11 113.732 -176.078 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.422 HD13 ' HA ' ' A' ' 6' ' ' ALA . 18.8 mm -125.98 132.02 71.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.972 -0.614 . . . . 0.13 109.451 -177.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.543 HD11 HD11 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.25 136.38 34.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 110.014 -0.365 . . . . 0.13 110.014 -177.181 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.09 129.84 30.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.9 0.381 . . . . 0.10000000000000001 111.318 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 3' ' ' HIS . 65.4 mt -86.25 132.64 31.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 110.011 -0.366 . . . . 0.27000000000000002 110.011 177.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -105.29 101.88 11.4 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.128 -0.487 . . . . 1.24 110.608 -175.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -116.5 167.95 10.6 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.374 -0.602 . . . . 1.2 109.374 175.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 76.8 -2.56 2.66 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 122.165 0.984 . . . . 0.57999999999999996 109.964 -175.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 23' ' ' SER . 30.4 m -102.64 -174.52 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.022 0 CA-C-N 114.051 -1.431 . . . . 0.25 109.324 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.614 ' O ' HG23 ' A' ' 22' ' ' VAL . 75.6 m -72.4 167.14 35.36 Favored Pre-proline 0 C--N 1.314 -0.942 0 N-CA-C 105.198 -2.149 . . . . 1.1299999999999999 105.198 175.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.429 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 94.8 Cg_exo -41.9 127.75 3.78 Favored 'Trans proline' 0 C--N 1.354 0.85 0 CA-C-N 121.213 1.469 . . . . 0.16 112.136 -141.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.481 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.07 139.32 23.32 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 113.97 -1.468 . . . . 0.10000000000000001 112.17 -163.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 24' ' ' PRO . 0.7 OUTLIER -125.48 168.44 13.63 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 114.225 -1.352 . . . . 0.32000000000000001 111.823 -169.847 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.765 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -116.83 105.42 12.35 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 107.365 -1.346 . . . . 0.089999999999999997 107.365 174.017 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.6 m -101.85 107.09 18.17 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 121.061 0.458 . . . . 0.17000000000000001 111.122 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.9 t90 -85.21 132.04 34.34 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.044 -0.725 . . . . 0.14000000000000001 109.044 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.723 ' HG2' HG23 ' A' ' 37' ' ' VAL . 66.2 mtp180 -123.06 163.22 20.92 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 109.039 -0.726 . . . . 1.9099999999999999 109.039 172.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 p -71.26 177.52 3.83 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 108.95 -0.759 . . . . 0.59999999999999998 108.95 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.493 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.0 OUTLIER -58.34 -36.68 73.81 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.316 -0.553 . . . . 0.26000000000000001 111.017 179.684 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -88.98 -31.23 18.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.608 0.718 . . . . 2.1200000000000001 109.91 171.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.62 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 96.76 16.25 36.96 Favored Glycine 0 N--CA 1.447 -0.613 0 CA-C-N 114.978 -1.01 . . . . 0.23000000000000001 112.1 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -62.18 -43.47 98.75 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.084 -0.71 . . . . 1.73 109.084 172.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.1 tttt -89.9 141.73 28.37 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.76 -0.83 . . . . 1.3 108.76 174.271 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.723 HG23 ' HG2' ' A' ' 30' ' ' ARG . 7.9 p -149.4 136.46 13.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.942 0.401 . . . . 0.17000000000000001 111.272 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -144.28 127.26 16.44 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.634 -0.506 . . . . 0.40999999999999998 109.634 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 36.7 m -117.11 132.83 56.58 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.812 0.671 . . . . 0.14999999999999999 112.812 -173.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.765 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -99.27 130.05 48.81 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.611 0 N-CA-C 108.017 -1.105 . . . . 0.12 108.017 168.693 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.421 ' O ' HG12 ' A' ' 45' ' ' ILE . 57.8 t -93.16 122.31 44.55 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 O-C-N 121.071 -1.018 . . . . 0.11 109.099 173.28 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.603 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.38 -19.38 63.83 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.736 0.643 . . . . 0.080000000000000002 112.736 -170.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.422 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 13.7 p -69.8 -12.29 61.51 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.366 0.603 . . . . 0.87 109.635 174.812 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.4 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 4.7 p -112.62 13.8 20.02 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.328 -0.851 . . . . 0.14999999999999999 109.879 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.554 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.5 mm -114.97 144.77 21.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.303 -0.629 . . . . 0.12 109.303 177.6 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -114.85 -37.39 4.2 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.691 0.281 . . . . 0.52000000000000002 111.168 -177.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.45 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 9.8 mtmm -139.26 168.8 19.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.732 0.301 . . . . 1.4099999999999999 111.43 -179.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.815 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -152.04 137.97 18.1 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 109.408 -0.59 . . . . 0.72999999999999998 109.408 -179.521 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 9.5 mm-40 -134.53 115.21 13.64 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 122.175 -0.328 . . . . 1.9399999999999999 111.505 -171.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.567 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -114.44 144.41 43.35 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.765 -0.584 . . . . 0.22 112.195 -177.567 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 69.0 p -68.55 119.66 70.05 Favored Pre-proline 0 C--O 1.233 0.237 0 CA-C-N 115.418 -0.81 . . . . 0.26000000000000001 110.784 -176.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.84 155.16 14.96 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.798 2.332 . . . . 0.38 111.723 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.6 -17.09 62.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.66000000000000003 112.402 -174.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.5 t -99.81 -7.79 24.99 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.806 0.336 . . . . 1.5 110.766 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.2 m -71.87 138.5 48.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.218 0.532 . . . . 0.84999999999999998 111.482 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -55.78 -23.66 31.16 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.038 -0.983 . . . . 1.77 111.084 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -88.67 148.55 23.96 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.874 -1.057 . . . . 1.6299999999999999 111.875 -174.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.619 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -118.87 95.46 4.84 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.12 -1.067 . . . . 1.1100000000000001 108.12 166.609 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.619 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -157.5 158.56 35.95 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.524 0.678 . . . . 0.22 112.505 -173.793 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -140.67 119.89 12.94 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.651 -1.158 . . . . 0.10000000000000001 108.318 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.706 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.2 mtp180 -102.53 147.53 26.65 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.426 0.631 . . . . 2.9900000000000002 112.014 -178.266 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.922 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -125.32 105.3 9.0 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.431 -1.259 . . . . 0.13 108.987 178.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.528 HD12 ' N ' ' A' ' 63' ' ' ILE . 3.1 mp -88.91 106.15 16.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 110.137 -0.32 . . . . 0.28999999999999998 110.137 -174.079 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.459 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -66.52 166.2 39.05 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.936 -0.575 . . . . 0.54000000000000004 112.925 -178.006 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.528 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 83.0 mttt . . . . . 0 C--N 1.317 -0.844 0 CA-C-O 120.861 0.363 . . . . 0.55000000000000004 111.362 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.562 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 14.0 m-20 . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 108.995 -0.742 . . . . 3.23 108.995 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -69.25 -2.6 11.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.957 0.408 . . . . 2.3900000000000001 111.42 -174.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.9 p -65.12 -17.33 64.38 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.524 -0.547 . . . . 2.96 109.524 169.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.562 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -79.42 132.53 36.41 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.187 0.994 . . . . 2.4900000000000002 110.528 176.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.4 mmtm -101.4 116.85 33.73 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 114.646 -1.161 . . . . 3.3999999999999999 109.246 167.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 41.0 ttm180 -99.33 157.57 16.31 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.463 -0.94 . . . . 3.7999999999999998 108.463 176.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 50.9 mttp -128.25 147.19 50.58 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.811 -0.441 . . . . 4.29 109.811 174.558 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.29 -172.86 3.61 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.554 -0.748 . . . . 4.4100000000000001 110.483 -175.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -58.55 -31.42 67.95 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.093 0.405 . . . . 5.3399999999999999 112.093 -178.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.591 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 30.8 mt-10 -85.49 -22.69 28.1 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.907 -0.317 . . . . 5.3799999999999999 110.96 -178.228 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 105.7 19.11 10.65 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.624 -0.798 . . . . 4.3700000000000001 112.38 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.591 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 37.9 m-80 -77.88 140.61 39.34 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.383 -0.599 . . . . 4.5099999999999998 109.383 177.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -74.23 95.67 2.66 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.469 -0.567 . . . . 4.2800000000000002 109.469 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.3 m -107.88 98.79 7.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 109.003 -0.739 . . . . 3.1000000000000001 109.003 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.426 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -89.0 114.55 60.62 Favored Pre-proline 0 C--N 1.316 -0.866 0 CA-C-N 115.892 -0.595 . . . . 2.5 110.375 -175.823 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 25.5 Cg_exo . . . . . 0 CA--C 1.51 -0.721 0 C-N-CA 123.036 2.491 . . . . 1.8700000000000001 113.716 -174.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 67.1 m80 . . . . . 0 C--O 1.218 -0.583 0 N-CA-C 107.505 -1.295 . . . . 0.71999999999999997 107.505 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.706 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 19.5 ttm -140.74 130.55 24.39 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 118.914 0.779 . . . . 0.27000000000000002 111.309 175.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.551 ' O ' ' HA ' ' A' ' 59' ' ' MET . 11.6 m-85 -116.61 138.05 51.72 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.371 -0.831 . . . . 0.27000000000000002 109.614 178.087 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.782 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -81.06 159.04 24.87 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 109.078 -0.712 . . . . 1.26 109.078 174.381 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 18.1 m-85 -138.34 175.47 9.55 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.91 0.386 . . . . 0.32000000000000001 111.478 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -130.63 -0.75 4.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.828 -0.624 . . . . 2.3799999999999999 110.115 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.505 ' HB2' HG23 ' A' ' 96' ' ' VAL . 62.2 m-80 -147.1 133.55 19.69 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.176 -0.465 . . . . 1.1000000000000001 110.223 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.429 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 36.0 mmt180 -72.01 -39.2 69.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.632 -0.713 . . . . 3.0899999999999999 111.208 -178.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.4 m -60.84 -33.44 73.05 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.994 -0.548 . . . . 0.34999999999999998 110.696 -177.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.638 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.3 t -67.25 -61.44 1.69 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 CA-C-N 116.052 -0.522 . . . . 0.23000000000000001 110.247 176.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.581 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.3 ptp -54.69 -38.58 67.18 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.25 -0.432 . . . . 0.17000000000000001 111.234 -175.39 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 102' ' ' MET . 29.9 t70 -62.98 -47.72 81.93 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.333 -0.394 . . . . 0.34000000000000002 110.511 177.369 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -68.95 -39.01 79.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.992 -0.549 . . . . 1.3600000000000001 111.619 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.668 HG22 HD11 ' A' ' 104' ' ' LEU . 35.7 mm -63.36 -58.92 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 109.039 -0.726 . . . . 0.12 109.039 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.811 ' HA ' HD12 ' A' ' 104' ' ' LEU . 14.6 ttpp -51.25 -47.76 62.34 Favored 'General case' 0 CA--C 1.508 -0.64 0 O-C-N 123.795 0.684 . . . . 0.79000000000000004 109.818 177.661 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.69 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 37.8 ttp -51.19 -55.28 18.77 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.065 -0.971 . . . . 0.28000000000000003 110.943 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.735 ' O ' HG13 ' A' ' 107' ' ' ILE . 31.9 m -60.41 -51.74 68.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.284 -0.416 . . . . 0.17999999999999999 110.455 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.922 HD13 HD21 ' A' ' 62' ' ' LEU . 31.7 mt -47.38 -54.96 9.85 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.409 0.684 . . . . 0.089999999999999997 110.312 175.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.666 ' CG ' HD13 ' A' ' 48' ' ' LEU . 23.5 mt-30 -53.7 -39.1 64.9 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.502 -1.226 . . . . 1.2 112.565 178.292 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.69 ' HG3' ' O ' ' A' ' 102' ' ' MET . 17.0 mt-30 -67.2 -42.46 84.09 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.863 0.839 . . . . 2.3700000000000001 109.04 177.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.735 HG13 ' O ' ' A' ' 103' ' ' THR . 14.1 mt -64.8 -46.79 90.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.298 -1.319 . . . . 0.14999999999999999 110.997 -179.253 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.815 HD12 HD11 ' A' ' 48' ' ' LEU . 7.6 mt -61.95 -32.22 53.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.841 -0.618 . . . . 0.19 111.222 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.408 ' HA ' ' HB2' ' A' ' 112' ' ' LYS . 38.5 t -61.44 -31.51 71.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.488 -0.324 . . . . 1.1399999999999999 110.399 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -63.57 -40.19 96.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.375 0.607 . . . . 1.6399999999999999 109.387 175.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.422 ' CG ' ' HA ' ' A' ' 43' ' ' SER . 35.0 m-85 -97.7 18.28 15.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.445 -0.798 . . . . 0.65000000000000002 110.103 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.408 ' HB2' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.627 0 N-CA-C 107.717 -1.216 . . . . 0.76000000000000001 107.717 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 73.1 m80 . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 112.365 0.506 . . . . 0.75 112.365 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.2 p -156.91 166.2 34.02 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.519 0.563 . . . . 1.0900000000000001 112.519 -171.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.482 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 174.45 -166.67 38.68 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.595 -1.002 . . . . 0.16 110.595 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.3 134.33 36.9 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 117.798 0.799 . . . . 0.16 110.301 178.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.424 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -147.36 144.74 28.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.171 0.51 . . . . 0.11 111.628 -178.121 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.498 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 98.2 mt -102.79 119.42 51.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.848 -0.615 . . . . 0.33000000000000002 110.166 176.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.428 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.8 t80 -126.1 137.2 53.59 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 109.142 -0.688 . . . . 0.35999999999999999 109.142 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 62.07 22.95 13.48 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.522 0.514 . . . . 0.80000000000000004 109.761 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt 67.92 5.22 4.4 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.279 -0.873 . . . . 2.1099999999999999 112.764 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.428 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.5 OUTLIER -95.48 126.88 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 108.671 -0.863 . . . . 0.22 108.671 166.447 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.456 ' HA ' HG12 ' A' ' 8' ' ' ILE . 27.3 p -77.35 142.8 39.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.226 0.536 . . . . 1.0700000000000001 111.049 -175.681 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.92 -158.59 9.8 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 120.26 -0.971 . . . . 0.11 113.228 -177.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 35.1 mm -125.29 131.41 72.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 109.351 -0.611 . . . . 0.13 109.351 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.57 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -101.99 135.07 40.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 120.788 0.327 . . . . 0.13 110.144 -176.726 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.65 130.95 32.98 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.22 -0.446 . . . . 0.10000000000000001 111.024 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.439 HD13 ' CG2' ' A' ' 103' ' ' THR . 34.3 mt -85.03 137.44 20.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.271 0.557 . . . . 0.27000000000000002 110.171 177.538 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -109.31 105.05 14.3 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.144 -0.935 . . . . 1.24 111.232 -173.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.49 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -124.05 169.96 11.14 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.168 -0.469 . . . . 1.2 109.744 176.04 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.49 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.6 t70 80.96 -6.12 1.64 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 122.452 1.12 . . . . 0.57999999999999996 109.293 -173.077 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 23' ' ' SER . 32.4 m -102.33 -172.48 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-N 113.699 -1.591 . . . . 0.25 109.128 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.602 ' O ' HG23 ' A' ' 22' ' ' VAL . 19.9 m -72.07 167.48 31.42 Favored Pre-proline 0 C--N 1.316 -0.878 0 N-CA-C 105.687 -1.968 . . . . 1.1299999999999999 105.687 175.462 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 23' ' ' SER . 63.9 Cg_exo -41.7 127.39 3.47 Favored 'Trans proline' 0 C--N 1.352 0.719 0 CA-C-N 120.81 1.325 . . . . 0.16 112.728 -143.057 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.461 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -45.22 138.15 4.13 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 113.61 -1.632 . . . . 0.10000000000000001 112.739 -166.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.55 169.34 12.0 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 113.908 -1.496 . . . . 0.32000000000000001 111.615 -169.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.709 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.81 108.92 15.94 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 107.761 -1.2 . . . . 0.089999999999999997 107.761 173.435 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.3 m -104.26 108.26 19.57 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.015 0.436 . . . . 0.17000000000000001 111.176 -176.133 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.42 ' CD2' ' HB3' ' A' ' 9' ' ' PHE . 84.2 t90 -86.43 130.45 34.5 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.211 -0.662 . . . . 0.14000000000000001 109.211 172.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.52 ' HG2' HG23 ' A' ' 37' ' ' VAL . 78.1 mtt180 -123.36 157.3 33.62 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 109.027 -0.731 . . . . 1.9099999999999999 109.027 172.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.2 p -70.38 177.95 3.14 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.486 -0.561 . . . . 0.59999999999999998 109.486 178.006 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.2 p -62.45 -38.29 89.21 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.905 -0.718 . . . . 0.26000000000000001 110.405 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -78.8 -33.01 46.56 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.811 0.815 . . . . 2.1200000000000001 108.969 171.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.457 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 91.89 10.53 61.3 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 114.459 -1.246 . . . . 0.23000000000000001 112.637 177.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -65.44 -48.79 71.52 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.586 -0.524 . . . . 1.73 109.586 175.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.4 tttm -77.25 134.31 38.61 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.821 -0.807 . . . . 1.3 108.821 172.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.52 HG23 ' HG2' ' A' ' 30' ' ' ARG . 13.6 p -149.39 136.49 13.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 120.672 0.273 . . . . 0.17000000000000001 110.701 -177.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -144.49 132.85 21.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.667 0.27 . . . . 0.40999999999999998 110.316 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.434 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 37.0 m -116.52 133.43 56.02 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.501 0.556 . . . . 0.14999999999999999 112.501 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.709 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.44 129.8 53.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.599 0 N-CA-C 108.383 -0.969 . . . . 0.12 108.383 169.247 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.6 t -92.53 119.63 40.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 O-C-N 121.207 -0.933 . . . . 0.11 108.805 173.487 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.53 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -66.94 -18.18 65.26 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.984 0.735 . . . . 0.080000000000000002 112.984 -170.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.425 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 44.3 t -70.81 -14.94 62.6 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.204 -0.598 . . . . 0.87 109.624 175.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.447 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 3.5 p -109.34 9.97 25.61 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.517 -0.765 . . . . 0.14999999999999999 110.002 -178.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.56 HG21 HD13 ' A' ' 62' ' ' LEU . 31.0 mm -110.36 137.91 40.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.831 -0.622 . . . . 0.12 109.327 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -103.29 -40.22 6.49 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.319 -0.4 . . . . 0.52000000000000002 110.591 -175.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.591 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 25.2 mtpp -139.79 174.51 10.44 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.406 0.622 . . . . 1.4099999999999999 111.962 -178.314 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.637 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -152.92 137.57 16.9 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.785 -1.098 . . . . 0.72999999999999998 108.754 176.898 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -134.02 118.41 17.78 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 122.436 -0.165 . . . . 1.9399999999999999 111.416 -173.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.454 ' HB2' ' HG ' ' A' ' 60' ' ' LEU . . . -117.42 144.09 45.34 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 122.062 -0.399 . . . . 0.22 111.693 -177.671 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.514 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 74.2 p -70.67 121.28 83.25 Favored Pre-proline 0 N--CA 1.463 0.202 0 CA-C-N 115.884 -0.598 . . . . 0.26000000000000001 111.162 -175.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.56 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 22.6 Cg_exo -58.41 160.55 16.45 Favored 'Trans proline' 0 CA--C 1.528 0.204 0 C-N-CA 122.866 2.378 . . . . 0.38 111.939 175.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.16 -13.92 62.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 0.66000000000000003 111.364 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.3 p -91.87 -15.49 28.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.263 0.554 . . . . 1.5 110.547 176.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.56 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 20.9 m -71.85 143.26 49.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.618 -0.719 . . . . 0.84999999999999998 111.608 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -69.16 -8.32 44.44 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 114.951 -1.022 . . . . 1.77 110.653 176.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 30.5 mmtm -105.39 155.74 18.84 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 114.79 -1.095 . . . . 1.6299999999999999 111.121 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.514 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 72.5 mmm -133.0 98.27 4.24 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.174 -0.676 . . . . 1.1100000000000001 109.174 169.281 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.568 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.2 OUTLIER -157.88 160.59 37.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.01 -0.541 . . . . 0.22 111.562 -171.037 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -136.99 118.77 15.09 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.387 -0.968 . . . . 0.10000000000000001 108.387 176.748 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.482 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 2.2 mtp180 -103.64 136.87 42.55 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.211 0.529 . . . . 2.9900000000000002 111.439 -178.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.923 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -109.03 107.6 18.0 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.055 -0.975 . . . . 0.13 109.243 174.039 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.591 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.3 mp -85.56 101.7 10.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 110.137 -0.32 . . . . 0.28999999999999998 110.137 -174.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.25 153.62 50.64 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 116.111 -0.495 . . . . 0.54000000000000004 112.273 178.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.447 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 86.8 mttt . . . . . 0 C--N 1.319 -0.737 0 CA-C-O 121.129 0.49 . . . . 0.55000000000000004 111.758 -176.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.832 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 15.2 t70 . . . . . 0 N--CA 1.45 -0.475 0 N-CA-C 107.965 -1.124 . . . . 3.23 107.965 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -75.76 -9.09 58.3 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.773 0.321 . . . . 2.3900000000000001 110.963 -174.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.1 p -66.87 -9.52 38.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.061 0.458 . . . . 2.96 110.618 174.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.832 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 4.9 ptpp? -86.43 33.3 0.63 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.011 -0.541 . . . . 2.4900000000000002 110.386 173.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -43.72 113.33 0.5 Allowed 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.474 0.654 . . . . 3.3999999999999999 109.746 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.506 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 73.5 ttt180 -102.07 165.67 11.03 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 114.872 -1.058 . . . . 3.7999999999999998 109.064 -167.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 85.8 mttt -134.67 150.43 50.63 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.607 -0.516 . . . . 4.29 109.607 171.497 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.495 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.8 OUTLIER -84.69 -170.85 3.32 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.606 -0.725 . . . . 4.4100000000000001 110.416 -177.619 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -59.15 -32.13 69.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.772 0.32 . . . . 5.3399999999999999 111.619 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.495 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 19.4 mt-10 -80.68 -45.13 17.67 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.931 0.396 . . . . 5.3799999999999999 110.528 -179.066 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 130.77 17.08 1.55 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.69 -0.767 . . . . 4.3700000000000001 112.466 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.561 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 36.6 m-80 -76.03 133.7 40.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.703 -0.48 . . . . 4.5099999999999998 109.703 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.444 ' HA ' ' HG2' ' A' ' 73' ' ' LYS . 43.7 tt0 -71.16 93.76 1.09 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.255 0.55 . . . . 4.2800000000000002 110.499 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 28.3 m -98.75 100.17 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-O 121.727 0.775 . . . . 3.1000000000000001 109.455 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -86.88 107.48 14.37 Favored Pre-proline 0 C--N 1.316 -0.873 0 N-CA-C 108.715 -0.846 . . . . 2.5 108.715 176.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo . . . . . 0 C--O 1.235 0.35 0 C-N-CA 123.535 2.824 . . . . 1.8700000000000001 113.579 -170.454 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.601 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 44.3 m80 . . . . . 0 C--O 1.222 -0.381 0 N-CA-C 108.774 -0.824 . . . . 0.71999999999999997 108.774 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.568 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 23.5 ttm -102.71 125.03 49.3 Favored 'General case' 0 CA--C 1.502 -0.87 0 C-N-CA 120.05 -0.66 . . . . 0.27000000000000002 111.012 -175.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.424 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.0 m-85 -112.83 125.33 54.23 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.271 -0.877 . . . . 0.27000000000000002 109.199 174.267 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.498 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -81.07 148.41 29.67 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.828 -0.434 . . . . 1.26 109.828 178.063 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.436 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 19.8 m-85 -130.01 168.57 16.5 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.283 0.563 . . . . 0.32000000000000001 111.783 -172.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -120.51 -11.11 9.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.143 -0.935 . . . . 2.3799999999999999 109.833 175.028 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.482 ' HB2' HG23 ' A' ' 96' ' ' VAL . 53.6 m-80 -136.85 128.67 29.06 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.373 0.606 . . . . 1.1000000000000001 110.814 -178.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.488 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.2 mmm180 -68.03 -35.91 79.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.117 -0.947 . . . . 3.0899999999999999 111.881 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.0 m -61.63 -37.97 85.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.783 0.325 . . . . 0.34999999999999998 110.747 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.596 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.5 t -66.17 -58.41 6.78 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 CA-C-N 116.221 -0.445 . . . . 0.23000000000000001 110.468 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.512 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.0 ptp -55.8 -39.49 71.37 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.333 -0.394 . . . . 0.17000000000000001 111.286 -176.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.462 ' N ' ' HG3' ' A' ' 97' ' ' MET . 28.7 t70 -65.65 -39.25 91.19 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.87 -0.332 . . . . 0.34000000000000002 110.332 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -74.44 -40.13 62.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.175 -0.466 . . . . 1.3600000000000001 111.433 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.643 HG22 HD11 ' A' ' 104' ' ' LEU . 30.6 mm -61.72 -57.23 13.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 108.692 -0.855 . . . . 0.12 108.692 176.004 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.769 ' HA ' HD12 ' A' ' 104' ' ' LEU . 30.0 ttpt -50.66 -49.69 56.43 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 124.09 0.868 . . . . 0.79000000000000004 109.848 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.476 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.0 ttp -49.98 -52.65 32.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.562 -0.745 . . . . 0.28000000000000003 111.26 178.004 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.678 ' O ' HG13 ' A' ' 107' ' ' ILE . 23.3 m -59.68 -56.82 17.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.992 -0.549 . . . . 0.17999999999999999 110.169 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.923 HD13 HD21 ' A' ' 62' ' ' LEU . 26.4 mt -45.6 -54.79 7.13 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.207 -0.906 . . . . 0.089999999999999997 110.663 176.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.619 ' CG ' HD13 ' A' ' 48' ' ' LEU . 92.9 mt-30 -51.56 -46.33 63.36 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.704 -1.135 . . . . 1.2 112.488 177.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 102' ' ' MET . 85.5 mm-40 -67.14 -34.77 78.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.46 0.648 . . . . 2.3700000000000001 109.968 -179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.678 HG13 ' O ' ' A' ' 103' ' ' THR . 7.3 mt -71.35 -46.25 65.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 114.669 -1.15 . . . . 0.14999999999999999 110.924 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.637 HD12 HD11 ' A' ' 48' ' ' LEU . 6.3 mt -59.24 -42.13 86.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.255 -0.43 . . . . 0.19 111.287 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.417 ' HA ' ' HB3' ' A' ' 112' ' ' LYS . 26.0 t -57.09 -28.33 62.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.5 -0.318 . . . . 1.1399999999999999 111.12 -177.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -60.95 -39.0 87.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.408 0.623 . . . . 1.6399999999999999 109.938 176.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.425 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 21.0 m-85 -94.47 -16.23 23.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.265 -0.88 . . . . 0.65000000000000002 110.205 -178.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.417 ' HB3' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.568 0 CA-C-N 115.527 -0.761 . . . . 0.76000000000000001 109.039 176.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.58 ' HA ' HD12 ' A' ' 18' ' ' ILE . 77.2 m80 . . . . . 0 C--O 1.22 -0.473 0 N-CA-C 112.304 0.483 . . . . 0.75 112.304 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.8 p -157.78 161.77 38.45 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 119.72 -0.792 . . . . 1.0900000000000001 112.376 -175.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.491 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.02 -165.72 34.84 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 115.009 -0.996 . . . . 0.16 110.749 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.19 130.55 45.51 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.23 0.515 . . . . 0.16 110.44 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.4 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -144.63 143.58 30.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.043 0.449 . . . . 0.11 111.351 -177.165 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' A' ' 13' ' ' SER . 74.2 mt -99.23 128.27 51.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.647 -0.501 . . . . 0.33000000000000002 109.647 174.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 12' ' ' VAL . 15.0 t80 -139.31 138.55 36.79 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.992 -0.744 . . . . 0.35999999999999999 108.992 178.022 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 64.35 24.88 13.34 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.65 0.594 . . . . 0.80000000000000004 109.494 -176.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp 65.72 1.02 1.64 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 114.992 -1.004 . . . . 2.1099999999999999 113.027 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -94.53 130.06 43.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.863 -0.791 . . . . 0.22 108.863 168.688 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.434 ' HA ' HG12 ' A' ' 8' ' ' ILE . 20.4 m -78.68 144.08 35.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.824 0.345 . . . . 1.0700000000000001 110.609 -175.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.401 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -162.34 -158.97 9.92 Favored Glycine 0 N--CA 1.439 -1.148 0 C-N-CA 119.92 -1.133 . . . . 0.11 113.743 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.4 mm -127.59 134.53 65.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.862 -0.792 . . . . 0.13 108.862 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.556 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.97 136.91 36.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.603 -0.271 . . . . 0.13 110.337 -176.034 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.68 130.03 31.52 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.911 0.386 . . . . 0.10000000000000001 111.436 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.58 HD12 ' HA ' ' A' ' 3' ' ' HIS . 64.3 mt -86.2 135.45 25.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.308 -0.405 . . . . 0.27000000000000002 110.022 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -106.75 103.36 12.78 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.005 -0.543 . . . . 1.24 110.902 -175.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 21.1 mt-10 -119.2 169.47 9.93 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.81 -0.811 . . . . 1.2 108.81 175.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 36.3 t70 78.97 -2.25 2.28 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.445 1.117 . . . . 0.57999999999999996 109.443 -176.092 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 23' ' ' SER . 34.8 m -104.0 -173.01 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-N 113.675 -1.602 . . . . 0.25 110.314 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.627 ' O ' HG23 ' A' ' 22' ' ' VAL . 75.6 m -72.06 167.63 30.02 Favored Pre-proline 0 C--N 1.316 -0.889 0 N-CA-C 105.23 -2.137 . . . . 1.1299999999999999 105.23 172.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -41.77 129.06 3.93 Favored 'Trans proline' 0 C--N 1.355 0.917 0 CA-C-N 121.345 1.516 . . . . 0.16 112.577 -144.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.479 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.77 142.64 18.31 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 114.124 -1.398 . . . . 0.10000000000000001 112.336 -163.439 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.26 169.11 13.86 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 114.332 -1.304 . . . . 0.32000000000000001 111.787 -169.132 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.718 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -120.75 105.5 10.8 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.803 -1.184 . . . . 0.089999999999999997 107.803 174.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.9 m -102.48 107.5 18.49 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 121.072 0.463 . . . . 0.17000000000000001 111.414 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.406 ' CD2' ' HB3' ' A' ' 9' ' ' PHE . 84.8 t90 -85.17 132.32 34.31 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.222 -0.659 . . . . 0.14000000000000001 109.222 172.254 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HG2' HG23 ' A' ' 37' ' ' VAL . 63.7 mtt180 -125.75 159.37 32.53 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 108.92 -0.77 . . . . 1.9099999999999999 108.92 173.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 p -69.25 176.44 3.3 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 109.31 -0.626 . . . . 0.59999999999999998 109.31 178.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.401 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.8 p -57.87 -41.39 82.34 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.403 -0.519 . . . . 0.26000000000000001 111.205 -178.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.86 -32.09 21.89 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.389 -0.597 . . . . 2.1200000000000001 109.389 171.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.431 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 101.01 17.33 23.16 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.457 -0.792 . . . . 0.23000000000000001 113.84 172.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.77 -44.36 77.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.253 0.526 . . . . 1.73 109.752 174.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.6 tttm -82.98 137.22 34.25 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.644 -0.872 . . . . 1.3 108.644 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.444 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.4 p -149.89 138.49 14.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.799 0.333 . . . . 0.17000000000000001 111.432 -176.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -143.98 126.45 15.88 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.618 -0.512 . . . . 0.40999999999999998 109.618 176.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 92.2 m -111.64 136.44 50.86 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.135 0.42 . . . . 0.14999999999999999 112.135 -176.081 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.718 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.37 128.61 57.73 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.704 0 N-CA-C 108.154 -1.054 . . . . 0.12 108.154 169.904 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.438 ' O ' HG12 ' A' ' 45' ' ' ILE . 70.5 t -92.73 121.62 43.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 O-C-N 121.108 -0.995 . . . . 0.11 108.773 173.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.8 -17.08 63.39 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.923 0.712 . . . . 0.080000000000000002 112.923 -169.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.9 p -72.04 -11.63 60.85 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.205 -0.598 . . . . 0.87 109.557 174.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 p -111.4 9.09 21.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.615 -0.721 . . . . 0.14999999999999999 109.711 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.586 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.8 mm -113.33 141.49 28.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 108.963 -0.754 . . . . 0.12 108.963 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -107.08 -44.69 4.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.982 0.42 . . . . 0.52000000000000002 110.489 -179.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.598 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 24.5 mtpp -133.0 172.16 13.0 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-O 121.711 0.767 . . . . 1.4099999999999999 111.895 -175.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.622 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -153.28 138.93 17.84 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.332 -1.304 . . . . 0.72999999999999998 108.284 178.414 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -137.23 118.56 14.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 117.736 0.244 . . . . 1.9399999999999999 110.914 -173.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.47 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -115.04 141.6 47.77 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.715 0.293 . . . . 0.22 111.358 -177.658 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.47 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 73.3 p -65.68 120.29 67.31 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 115.764 -0.653 . . . . 0.26000000000000001 111.01 -176.446 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.538 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 10.4 Cg_exo -60.42 161.51 20.19 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.395 2.063 . . . . 0.38 111.54 176.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.09 -21.48 65.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.66000000000000003 110.92 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.4 p -78.81 -18.17 54.52 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.917 -0.583 . . . . 1.5 110.614 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.538 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 37.8 m -75.93 139.53 41.64 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.701 -0.681 . . . . 0.84999999999999998 111.143 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.36 -11.92 46.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.129 -0.941 . . . . 1.77 110.712 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.445 ' HB3' HG21 ' A' ' 51' ' ' THR . 9.5 mptt -102.5 155.39 18.3 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 114.748 -1.115 . . . . 1.6299999999999999 111.783 -174.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.47 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 71.9 mmm -130.77 99.38 4.92 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.359 -0.837 . . . . 1.1100000000000001 109.296 170.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.464 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.6 OUTLIER -156.06 157.65 36.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.751 -0.659 . . . . 0.22 111.674 -173.224 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.7 tt -132.01 119.31 20.89 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 108.353 -0.98 . . . . 0.10000000000000001 108.353 176.249 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.444 ' HA ' ' HA ' ' A' ' 88' ' ' MET . 54.9 mtm180 -101.62 140.58 35.72 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 120.849 0.357 . . . . 2.9900000000000002 111.075 -178.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.933 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -116.72 105.25 12.2 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.429 -0.805 . . . . 0.13 109.403 175.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.598 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.5 mp -86.03 107.78 16.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 122.551 0.34 . . . . 0.28999999999999998 110.317 -173.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -62.26 164.11 24.94 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.989 -0.624 . . . . 0.54000000000000004 112.621 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 74.4 mttt . . . . . 0 C--N 1.318 -0.794 0 CA-C-O 121.237 0.541 . . . . 0.55000000000000004 111.687 -179.831 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.666 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 36.6 m-20 . . . . . 0 CA--C 1.51 -0.593 0 N-CA-C 108.569 -0.9 . . . . 3.23 108.569 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -68.42 -1.29 6.17 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.128 0.418 . . . . 2.3900000000000001 112.128 -171.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.0 p -67.33 -17.9 64.95 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.344 0.592 . . . . 2.96 109.789 169.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.666 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -78.65 32.65 0.2 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.41 -0.814 . . . . 2.4900000000000002 111.183 178.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.417 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 12.0 mmmt -45.67 113.87 0.67 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.087 -0.708 . . . . 3.3999999999999999 109.087 -175.531 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.547 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 36.0 ttm180 -105.55 165.49 11.11 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 115.78 -0.646 . . . . 3.7999999999999998 109.289 -169.262 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 96.7 mttt -136.93 140.78 42.51 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.669 -0.493 . . . . 4.29 109.669 173.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -86.26 -165.04 1.14 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.221 -0.445 . . . . 4.4100000000000001 110.587 -176.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -60.95 -30.83 70.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 5.3399999999999999 111.317 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -82.95 -21.96 33.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.801 0.334 . . . . 5.3799999999999999 110.739 -177.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.99 14.19 37.35 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.139 -0.784 . . . . 4.3700000000000001 111.139 -175.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 80.0 m-20 -69.63 132.34 46.03 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 109.23 -0.655 . . . . 4.5099999999999998 109.23 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -70.73 92.91 0.9 Allowed 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.348 -0.612 . . . . 4.2800000000000002 109.348 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.547 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 17.4 m -101.22 98.62 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 CA-C-O 121.725 0.774 . . . . 3.1000000000000001 109.418 177.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -85.65 102.69 2.76 Favored Pre-proline 0 C--N 1.314 -0.965 0 N-CA-C 108.366 -0.976 . . . . 2.5 108.366 175.229 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 46.5 Cg_exo . . . . . 0 CA--C 1.516 -0.39 0 C-N-CA 123.357 2.705 . . . . 1.8700000000000001 113.478 -165.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 50.8 m80 . . . . . 0 C--O 1.219 -0.54 0 N-CA-C 108.96 -0.755 . . . . 0.71999999999999997 108.96 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.444 ' HA ' ' HA ' ' A' ' 61' ' ' ARG . 30.5 ttm -107.51 125.76 51.68 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 119.795 -0.762 . . . . 0.27000000000000002 111.254 -176.36 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.4 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.8 m-85 -114.05 129.1 56.63 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.263 -0.88 . . . . 0.27000000000000002 109.498 177.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.24 149.31 29.08 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.076 0.465 . . . . 1.26 110.275 178.041 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.424 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.7 m-85 -132.06 173.81 10.83 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.932 -0.576 . . . . 0.32000000000000001 110.682 -175.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -123.11 -20.89 5.59 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.953 -0.567 . . . . 2.3799999999999999 110.116 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -126.33 123.44 38.03 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.054 0.454 . . . . 1.1000000000000001 110.786 -177.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.526 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 15.4 mmm180 -60.77 -33.31 72.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.504 -0.771 . . . . 3.0899999999999999 112.654 179.063 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.8 m -64.38 -37.96 89.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.786 0.327 . . . . 0.34999999999999998 110.819 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.626 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.4 t -66.23 -56.19 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 CA-C-N 116.299 -0.41 . . . . 0.23000000000000001 110.489 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.588 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.8 ptp -57.24 -39.28 75.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.97 -0.559 . . . . 0.17000000000000001 110.828 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.482 ' N ' ' HG3' ' A' ' 97' ' ' MET . 32.4 t70 -66.63 -41.06 88.91 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 120.722 -0.391 . . . . 0.34000000000000002 110.451 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -69.22 -44.11 72.72 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.114 0.259 . . . . 1.3600000000000001 111.08 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.635 HG22 HD11 ' A' ' 104' ' ' LEU . 31.7 mm -61.09 -57.76 10.67 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 108.81 -0.811 . . . . 0.12 108.81 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.803 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.5 ttpt -50.83 -48.39 59.91 Favored 'General case' 0 C--O 1.215 -0.75 0 O-C-N 123.927 0.767 . . . . 0.79000000000000004 109.863 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.704 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 41.5 ttp -49.09 -56.99 7.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.716 -0.674 . . . . 0.28000000000000003 111.077 177.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.732 ' O ' HG13 ' A' ' 107' ' ' ILE . 26.0 m -58.72 -51.96 67.73 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.468 0.48 . . . . 0.17999999999999999 110.473 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.933 HD13 HD21 ' A' ' 62' ' ' LEU . 29.1 mt -48.48 -54.03 15.76 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 123.451 0.701 . . . . 0.089999999999999997 110.613 175.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.58 ' HG2' HD13 ' A' ' 48' ' ' LEU . 60.0 mt-30 -50.56 -44.99 56.83 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.701 -1.136 . . . . 1.2 111.825 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.704 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.9 mt-30 -63.29 -42.21 99.06 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 122.001 0.905 . . . . 2.3700000000000001 108.986 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.732 HG13 ' O ' ' A' ' 103' ' ' THR . 10.2 mt -66.1 -45.98 89.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 114.1 -1.409 . . . . 0.14999999999999999 111.311 -178.439 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.508 HD12 HD11 ' A' ' 48' ' ' LEU . 9.0 mt -64.21 -40.77 90.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.218 -0.446 . . . . 0.19 111.493 -178.169 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.4 t -58.54 -23.3 57.98 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.383 -0.371 . . . . 1.1399999999999999 110.965 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -66.1 -52.14 51.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.427 0.632 . . . . 1.6399999999999999 109.652 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -79.01 -11.67 60.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.475 -0.784 . . . . 0.65000000000000002 110.441 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.604 0 N-CA-C 108.747 -0.834 . . . . 0.76000000000000001 108.747 173.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.517 ' HA ' HD12 ' A' ' 18' ' ' ILE . 76.4 m80 . . . . . 0 CA--C 1.512 -0.495 0 N-CA-C 110.734 -0.098 . . . . 0.75 110.734 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 t -152.53 149.08 28.12 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 118.885 -1.126 . . . . 1.0900000000000001 113.928 -170.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.489 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -169.28 -172.13 35.65 Favored Glycine 0 N--CA 1.439 -1.111 0 CA-C-N 113.668 -1.605 . . . . 0.16 109.745 177.201 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -91.53 132.38 36.32 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 117.834 0.817 . . . . 0.16 110.323 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.466 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -144.12 146.6 32.89 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.196 -0.456 . . . . 0.11 111.435 -177.728 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.558 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 98.3 mt -107.47 123.75 62.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.281 -0.418 . . . . 0.33000000000000002 110.706 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.424 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.0 t80 -127.19 137.54 52.95 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.305 -0.998 . . . . 0.35999999999999999 108.305 177.138 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 58.35 26.24 13.8 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 122.775 0.43 . . . . 0.80000000000000004 110.919 -178.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.4 mtmm 68.61 0.08 2.49 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.521 0.728 . . . . 2.1099999999999999 112.915 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.424 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -92.4 116.82 34.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 108.53 -0.915 . . . . 0.22 108.53 169.014 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.446 ' HA ' HG12 ' A' ' 8' ' ' ILE . 50.2 p -70.92 145.18 50.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.114 0.483 . . . . 1.0700000000000001 110.791 -176.234 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.0 -160.42 10.7 Favored Glycine 0 N--CA 1.436 -1.366 0 C-N-CA 120.297 -0.954 . . . . 0.11 113.087 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 23.0 mm -125.27 132.28 71.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.122 -0.695 . . . . 0.13 109.122 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.56 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -100.82 136.1 33.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 N-CA-C 109.856 -0.424 . . . . 0.13 109.856 -176.927 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.9 125.83 24.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.921 0.391 . . . . 0.10000000000000001 111.523 -179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.551 HG12 HD23 ' A' ' 27' ' ' LEU . 74.5 mt -85.28 132.8 30.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.779 -0.452 . . . . 0.27000000000000002 109.779 177.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -102.98 102.29 12.33 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.967 -0.56 . . . . 1.24 110.792 -174.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 13.5 mt-10 -116.02 170.16 8.7 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.256 -0.646 . . . . 1.2 109.256 176.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.447 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 35.5 t70 78.21 -4.59 2.18 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 122.394 1.092 . . . . 0.57999999999999996 109.704 -176.332 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.672 HG23 ' O ' ' A' ' 23' ' ' SER . 32.5 m -103.15 -172.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-N 113.765 -1.561 . . . . 0.25 110.028 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.672 ' O ' HG23 ' A' ' 22' ' ' VAL . 58.2 m -72.89 169.65 16.65 Favored Pre-proline 0 C--N 1.315 -0.898 0 N-CA-C 105.686 -1.968 . . . . 1.1299999999999999 105.686 173.613 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -41.96 129.21 4.19 Favored 'Trans proline' 0 C--N 1.359 1.126 0 CA-C-N 121.538 1.585 . . . . 0.16 112.328 -145.156 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.473 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -55.97 141.99 37.52 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 114.262 -1.335 . . . . 0.10000000000000001 112.051 -161.445 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -123.47 168.94 11.9 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.568 -1.196 . . . . 0.32000000000000001 111.915 -169.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.76 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -120.08 105.28 10.86 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 107.69 -1.226 . . . . 0.089999999999999997 107.69 173.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.415 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.2 m -100.91 106.81 18.19 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 116.554 -0.294 . . . . 0.17000000000000001 110.854 -176.169 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.41 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 83.8 t90 -85.07 130.41 34.62 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.98 -0.748 . . . . 0.14000000000000001 108.98 171.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 58.0 mtt180 -126.46 155.2 42.62 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.067 -0.716 . . . . 1.9099999999999999 109.067 174.123 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -69.0 176.19 3.29 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 109.634 -0.506 . . . . 0.59999999999999998 109.634 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.7 p -61.24 -32.42 72.21 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.224 -0.59 . . . . 0.26000000000000001 110.272 177.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -86.65 -31.64 20.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.674 0.749 . . . . 2.1200000000000001 108.981 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.5 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 88.62 9.97 68.16 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.573 -1.194 . . . . 0.23000000000000001 112.498 176.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -64.14 -48.42 76.13 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.795 -0.817 . . . . 1.73 108.795 173.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -77.35 136.1 38.42 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.284 -0.871 . . . . 1.3 109.134 173.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.456 HG23 ' HG2' ' A' ' 30' ' ' ARG . 11.6 p -150.15 139.24 15.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 120.739 0.304 . . . . 0.17000000000000001 111.089 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -144.47 121.43 11.35 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.659 -0.497 . . . . 0.40999999999999998 109.659 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 32.3 m -109.47 133.23 53.34 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.194 0.442 . . . . 0.14999999999999999 112.194 -175.066 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.76 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.11 129.23 53.81 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.702 0 N-CA-C 108.253 -1.017 . . . . 0.12 108.253 169.919 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.4 t -92.92 121.77 43.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 O-C-N 121.036 -1.04 . . . . 0.11 108.769 173.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.558 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.67 -20.88 64.46 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.151 0.797 . . . . 0.080000000000000002 113.151 -169.115 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.1 p -68.62 -14.56 63.09 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.159 -0.616 . . . . 0.87 109.735 174.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.3 p -111.1 14.86 21.84 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.568 -0.742 . . . . 0.14999999999999999 109.703 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.541 HG21 HD13 ' A' ' 62' ' ' LEU . 24.1 mm -113.08 138.73 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 115.641 -0.709 . . . . 0.12 109.217 176.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -104.15 -40.53 6.12 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.204 -0.453 . . . . 0.52000000000000002 110.51 -176.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.455 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 11.2 mtmm -141.62 170.64 15.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.325 -0.398 . . . . 1.4099999999999999 110.93 -177.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.616 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -149.69 141.66 23.84 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.498 -0.927 . . . . 0.72999999999999998 108.498 176.871 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.495 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 18.0 mm-40 -136.77 114.7 11.38 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 117.362 0.074 . . . . 1.9399999999999999 111.069 -171.288 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.45 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -113.34 142.72 45.53 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.98 -0.45 . . . . 0.22 111.229 -179.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.483 HG21 ' HB3' ' A' ' 57' ' ' LYS . 34.8 p -62.01 122.32 71.44 Favored Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 115.822 -0.626 . . . . 0.26000000000000001 110.985 -176.159 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.521 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 15.1 Cg_exo -59.21 159.6 21.97 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.554 2.169 . . . . 0.38 111.303 177.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.19 -14.81 63.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 0.66000000000000003 110.857 -179.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 p -85.84 -17.19 36.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.631 -0.713 . . . . 1.5 110.845 176.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.521 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 45.2 m -78.73 135.67 37.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.717 -0.674 . . . . 0.84999999999999998 111.133 -179.133 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -56.44 -34.44 66.84 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.333 -0.849 . . . . 1.77 110.061 172.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.483 ' HB3' HG21 ' A' ' 51' ' ' THR . 8.3 mptt -76.25 152.12 36.61 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 113.992 -1.458 . . . . 1.6299999999999999 111.927 -174.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.441 ' HB3' ' HE3' ' A' ' 58' ' ' MET . 85.7 mmm -129.48 98.55 4.89 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.304 -0.862 . . . . 1.1100000000000001 108.691 171.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.479 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.1 OUTLIER -154.07 153.84 32.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.882 -0.599 . . . . 0.22 111.53 -172.069 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.8 tt -130.33 118.91 21.99 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.342 -0.984 . . . . 0.10000000000000001 108.342 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.655 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 1.6 mtp180 -103.41 149.21 25.02 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.458 0.647 . . . . 2.9900000000000002 111.775 -178.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.934 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -127.65 104.98 8.16 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.38 -1.282 . . . . 0.13 108.901 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.538 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -88.3 105.0 15.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 110.196 -0.298 . . . . 0.28999999999999998 110.196 -173.578 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.479 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -62.69 160.45 33.37 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 116.181 -0.463 . . . . 0.54000000000000004 112.464 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.2 mttt . . . . . 0 C--N 1.316 -0.861 0 CA-C-O 121.654 0.74 . . . . 0.55000000000000004 112.664 -177.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.78 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 20.9 t70 . . . . . 0 C--O 1.211 -0.955 0 N-CA-C 109.208 -0.664 . . . . 3.23 109.208 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.61 -4.52 4.23 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.865 0.691 . . . . 2.3900000000000001 112.865 -170.746 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.57 -1.65 47.1 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.092 0.472 . . . . 2.96 110.673 172.33 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.78 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.2 ptmt -81.39 40.14 0.55 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.92 -0.582 . . . . 2.4900000000000002 110.331 172.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.494 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 25.1 mmtm -43.53 114.32 0.62 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.705 -0.68 . . . . 3.3999999999999999 110.665 -173.452 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 44.9 ttt180 -95.57 162.92 13.43 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 108.093 -1.077 . . . . 3.7999999999999998 108.093 -175.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 20.0 mtpt -128.29 132.81 48.67 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.182 -0.673 . . . . 4.29 109.182 172.179 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -77.37 -171.92 2.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.63 -0.713 . . . . 4.4100000000000001 110.696 -174.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -59.52 -32.05 69.94 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.775 0.287 . . . . 5.3399999999999999 111.775 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.506 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 25.0 mt-10 -83.71 -19.06 35.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.031 0.443 . . . . 5.3799999999999999 110.926 -179.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.434 ' O ' ' HE2' ' A' ' 73' ' ' LYS . . . 95.89 31.19 7.48 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.953 -0.567 . . . . 4.3700000000000001 112.753 178.018 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.579 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 39.7 m-80 -92.35 148.17 22.34 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.046 -0.724 . . . . 4.5099999999999998 109.046 175.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -72.55 89.38 1.28 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.11 0.481 . . . . 4.2800000000000002 109.778 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.578 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 12.3 m -99.36 99.31 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.983 0 CA-C-O 121.884 0.849 . . . . 3.1000000000000001 109.076 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.494 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.4 OUTLIER -85.22 119.38 72.33 Favored Pre-proline 0 C--N 1.31 -1.121 0 CA-C-N 115.601 -0.727 . . . . 2.5 109.994 -178.597 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 52.8 Cg_exo . . . . . 0 CA--C 1.513 -0.573 0 C-N-CA 122.638 2.225 . . . . 1.8700000000000001 112.274 -178.054 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.561 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 80.3 m-70 . . . . . 0 C--O 1.216 -0.673 0 N-CA-C 107.415 -1.328 . . . . 0.71999999999999997 107.415 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.655 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 8.1 ttm -141.1 125.49 17.6 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 119.049 0.84 . . . . 0.27000000000000002 110.931 176.379 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.466 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.6 m-85 -116.84 127.95 54.79 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.356 -0.838 . . . . 0.27000000000000002 109.654 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.558 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -80.93 150.72 28.88 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.717 0.294 . . . . 1.26 110.356 178.222 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.435 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 28.2 m-85 -133.46 175.47 9.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.515 0.674 . . . . 0.32000000000000001 111.649 -174.044 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -111.24 -29.44 7.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.952 -1.022 . . . . 2.3799999999999999 110.998 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -138.13 142.89 40.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.003 0.43 . . . . 1.1000000000000001 110.502 -177.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.61 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 11.0 mmm180 -64.99 -34.23 77.94 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.48 -0.782 . . . . 3.0899999999999999 111.011 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 57.0 m -58.74 -39.28 80.45 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.115 -0.493 . . . . 0.34999999999999998 110.626 -176.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.57 ' O ' HG12 ' A' ' 100' ' ' ILE . 9.7 t -67.15 -55.91 15.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.184 -0.462 . . . . 0.23000000000000001 110.026 177.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.61 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 14.0 ptp -61.86 -41.34 97.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.17000000000000001 111.237 -177.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.434 ' N ' ' HG3' ' A' ' 97' ' ' MET . 36.4 t70 -62.34 -37.1 84.36 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.394 -0.522 . . . . 0.34000000000000002 110.504 178.207 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.417 ' HA ' ' HE2' ' A' ' 102' ' ' MET . 18.4 m-20 -74.08 -43.46 57.62 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.332 -0.395 . . . . 1.3600000000000001 111.618 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.8 mm -63.71 -55.02 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 N-CA-C 108.962 -0.755 . . . . 0.12 108.962 176.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.875 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.8 ttpt -51.53 -45.48 62.98 Favored 'General case' 0 C--O 1.217 -0.609 0 O-C-N 123.574 0.546 . . . . 0.79000000000000004 109.783 177.22 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.624 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 38.8 ttp -50.91 -59.8 3.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.839 -0.619 . . . . 0.28000000000000003 111.308 177.15 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.794 ' O ' HG13 ' A' ' 107' ' ' ILE . 27.6 m -56.5 -49.77 73.75 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 123.471 0.482 . . . . 0.17999999999999999 110.263 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.934 HD13 HD21 ' A' ' 62' ' ' LEU . 30.9 mt -48.48 -55.32 11.28 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 123.026 0.53 . . . . 0.089999999999999997 110.579 174.13 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.547 ' HG2' HD13 ' A' ' 48' ' ' LEU . 63.1 mt-30 -54.22 -42.41 69.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.141 -0.936 . . . . 1.2 111.712 176.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.624 ' HG3' ' O ' ' A' ' 102' ' ' MET . 21.4 mt-30 -64.71 -28.64 69.73 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.769 0.795 . . . . 2.3700000000000001 109.457 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.794 HG13 ' O ' ' A' ' 103' ' ' THR . 10.7 mt -84.52 -45.34 17.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.672 -1.149 . . . . 0.14999999999999999 111.232 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.541 HD12 HD11 ' A' ' 48' ' ' LEU . 9.8 mt -63.24 -38.81 83.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.28 -0.418 . . . . 0.19 111.582 -177.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.424 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 4.7 p -57.75 -26.87 62.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.41 -0.359 . . . . 1.1399999999999999 111.351 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -62.6 -47.18 84.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.413 0.625 . . . . 1.6399999999999999 109.557 174.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -89.67 8.18 32.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.548 -0.751 . . . . 0.65000000000000002 110.186 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.424 ' CB ' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.516 0 N-CA-C 108.631 -0.877 . . . . 0.76000000000000001 108.631 176.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.623 ' HA ' HD12 ' A' ' 18' ' ' ILE . 77.8 m80 . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 112.835 0.68 . . . . 0.75 112.835 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.3 t -156.74 159.17 38.07 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 119.773 -0.771 . . . . 1.0900000000000001 112.131 -174.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.526 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.18 -168.82 39.78 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 114.478 -1.237 . . . . 0.16 110.099 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.7 131.93 39.99 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 117.49 0.645 . . . . 0.16 110.398 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.434 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -142.36 144.82 33.35 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.133 0.492 . . . . 0.11 111.561 -177.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.6 mt -111.52 119.45 59.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.883 -0.599 . . . . 0.33000000000000002 110.258 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -120.65 137.37 54.49 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.717 -0.846 . . . . 0.35999999999999999 108.717 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 54.74 26.57 7.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 122.737 0.415 . . . . 0.80000000000000004 111.019 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp 68.37 5.34 4.7 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.825 0.676 . . . . 2.1099999999999999 112.825 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.5 p -94.9 116.54 36.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 108.216 -1.031 . . . . 0.22 108.216 166.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.9 m -73.0 144.71 47.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.023 0.439 . . . . 1.0700000000000001 111.077 -175.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.0 -158.43 9.32 Favored Glycine 0 N--CA 1.437 -1.257 0 C-N-CA 120.686 -0.769 . . . . 0.11 112.803 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -125.95 134.62 66.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.184 -0.673 . . . . 0.13 109.184 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.586 HD11 HD11 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.14 135.34 39.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.983 -0.377 . . . . 0.13 109.983 -177.053 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.75 127.86 27.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.948 0.404 . . . . 0.10000000000000001 111.518 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.623 HD12 ' HA ' ' A' ' 3' ' ' HIS . 65.6 mt -86.02 133.75 28.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.169 -0.469 . . . . 0.27000000000000002 109.94 177.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -106.31 102.01 11.45 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.822 -0.626 . . . . 1.24 110.784 -174.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -116.28 169.35 9.36 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.189 -0.671 . . . . 1.2 109.189 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t70 76.7 -2.23 2.73 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 122.413 1.101 . . . . 0.57999999999999996 109.737 -176.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 23' ' ' SER . 33.3 m -103.47 -173.71 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 113.743 -1.572 . . . . 0.25 109.959 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.644 ' O ' HG23 ' A' ' 22' ' ' VAL . 59.5 m -72.96 168.56 23.48 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 105.306 -2.109 . . . . 1.1299999999999999 105.306 173.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.707 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 72.9 Cg_exo -40.7 128.32 2.58 Favored 'Trans proline' 0 C--N 1.356 0.941 0 CA-C-N 121.55 1.589 . . . . 0.16 112.821 -143.157 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.86 140.08 25.36 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 114.357 -1.292 . . . . 0.10000000000000001 112.039 -164.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -126.47 168.92 13.56 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.597 -1.183 . . . . 0.32000000000000001 112.076 -168.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.76 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -120.25 104.24 9.9 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 107.375 -1.343 . . . . 0.089999999999999997 107.375 174.098 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.7 m -101.69 107.87 19.23 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.07 0.462 . . . . 0.17000000000000001 111.116 -176.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -85.1 131.78 34.4 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.973 -0.751 . . . . 0.14000000000000001 108.973 172.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.487 ' HG2' HG23 ' A' ' 37' ' ' VAL . 96.3 mtt180 -126.2 158.15 36.38 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.156 -0.683 . . . . 1.9099999999999999 109.156 173.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -69.73 174.55 5.02 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.226 -0.657 . . . . 0.59999999999999998 109.226 178.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.6 p -60.96 -35.52 76.97 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 119.93 -0.708 . . . . 0.26000000000000001 110.504 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -85.58 -29.34 24.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.613 0.721 . . . . 2.1200000000000001 109.5 173.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.458 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 90.78 16.76 54.08 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 114.843 -1.072 . . . . 0.23000000000000001 112.68 175.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -69.1 -51.41 38.82 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.954 -0.758 . . . . 1.73 108.954 173.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.8 tttt -75.72 136.01 40.35 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.9 -0.778 . . . . 1.3 108.9 173.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.487 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.0 p -149.75 134.82 10.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 120.826 0.346 . . . . 0.17000000000000001 111.047 -177.095 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -143.87 121.09 11.53 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.977 -0.379 . . . . 0.40999999999999998 109.977 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.411 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 60.9 m -111.04 137.05 49.15 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.365 0.505 . . . . 0.14999999999999999 112.365 -174.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.76 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.85 130.18 56.27 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.668 0 N-CA-C 108.392 -0.966 . . . . 0.12 108.392 170.559 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.0 t -92.55 119.7 40.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 O-C-N 121.005 -1.059 . . . . 0.11 108.854 173.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.62 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -67.05 -22.82 65.85 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.662 0.615 . . . . 0.080000000000000002 112.662 -170.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.707 ' OG ' ' HB3' ' A' ' 24' ' ' PRO . 9.7 m -63.87 -18.39 64.12 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.57 0.7 . . . . 0.87 109.482 175.314 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.1 p -113.72 17.83 17.87 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.164 -0.925 . . . . 0.14999999999999999 110.034 -177.174 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.551 HD13 ' HA2' ' A' ' 64' ' ' GLY . 23.9 mm -113.95 140.82 32.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.896 -0.779 . . . . 0.12 108.896 176.041 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -102.4 -43.48 5.66 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.897 0.379 . . . . 0.52000000000000002 110.555 -176.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.476 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 17.2 mtmm -141.81 173.04 11.88 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.086 -0.507 . . . . 1.4099999999999999 110.988 -177.251 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.637 HD11 HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -151.57 148.63 28.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.621 -0.718 . . . . 0.72999999999999998 109.148 179.833 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.683 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 19.3 mm-40 -133.6 153.22 51.83 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 110.391 -0.226 . . . . 1.9399999999999999 110.391 -174.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.438 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -150.46 140.18 21.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.642 0.258 . . . . 0.22 110.785 176.237 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.457 HG21 ' HB3' ' A' ' 57' ' ' LYS . 40.9 p -66.3 118.06 49.52 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.614 -0.721 . . . . 0.26000000000000001 110.653 -177.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.412 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 12.7 Cg_exo -57.0 159.31 15.03 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.761 2.307 . . . . 0.38 111.897 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.44 -15.92 63.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.195 -0.457 . . . . 0.66000000000000003 111.316 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.7 m -83.53 -18.57 37.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.232 0.539 . . . . 1.5 110.998 175.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.412 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 73.2 m -79.29 138.31 37.7 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.492 -0.776 . . . . 0.84999999999999998 111.585 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -62.3 -30.89 71.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.244 -0.889 . . . . 1.77 110.317 174.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.457 ' HB3' HG21 ' A' ' 51' ' ' THR . 1.9 mptp? -77.35 153.01 34.18 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 114.183 -1.371 . . . . 1.6299999999999999 111.64 -175.183 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.424 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 1.0 OUTLIER -129.3 98.5 4.9 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.886 -1.052 . . . . 1.1100000000000001 108.639 172.052 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.472 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.1 OUTLIER -154.64 159.7 40.97 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.351 0.595 . . . . 0.22 111.878 -173.687 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -140.96 119.31 12.17 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.69 -1.141 . . . . 0.10000000000000001 108.416 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.683 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 25.5 mtp180 -103.7 136.68 42.95 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 121.285 0.565 . . . . 2.9900000000000002 110.863 -179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.914 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -111.51 104.39 12.8 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.601 -0.727 . . . . 0.13 109.197 176.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.526 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.7 mp -86.53 101.85 11.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.946 -0.39 . . . . 0.28999999999999998 109.946 -174.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.551 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -61.49 163.97 21.45 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.783 -0.644 . . . . 0.54000000000000004 112.784 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.526 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 82.0 mttt . . . . . 0 N--CA 1.442 -0.848 0 CA-C-O 121.954 0.883 . . . . 0.55000000000000004 112.816 -177.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.652 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 1.9 t70 . . . . . 0 CA--C 1.512 -0.509 0 N-CA-C 108.577 -0.897 . . . . 3.23 108.577 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.6 -7.61 3.51 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.881 0.697 . . . . 2.3900000000000001 112.881 -168.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.6 p -64.49 -19.47 65.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.306 0.574 . . . . 2.96 109.567 172.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.652 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.1 ptmt -76.41 40.49 0.22 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.382 -0.826 . . . . 2.4900000000000002 110.978 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.506 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 19.4 mmtm -44.21 113.48 0.54 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.508 -0.553 . . . . 3.3999999999999999 109.508 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.625 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 50.4 ttt180 -94.97 156.23 16.41 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.733 -0.84 . . . . 3.7999999999999998 108.733 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -130.36 134.62 47.3 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 121.333 0.587 . . . . 4.29 110.753 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -74.98 174.0 9.92 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.79 -1.096 . . . . 4.4100000000000001 110.157 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -51.94 -32.05 31.44 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.774 0.657 . . . . 5.3399999999999999 112.774 -174.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -87.66 7.56 29.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.696 0.284 . . . . 5.3799999999999999 111.428 -177.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.11 10.96 85.62 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.944 -0.646 . . . . 4.3700000000000001 112.011 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -72.08 131.62 43.09 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.342 -0.614 . . . . 4.5099999999999998 109.342 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -70.01 113.18 6.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.988 0.423 . . . . 4.2800000000000002 110.171 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.625 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 3.7 m -126.88 98.68 4.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 108.62 -0.882 . . . . 3.1000000000000001 108.62 176.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.506 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.6 p -97.17 124.67 48.57 Favored Pre-proline 0 C--N 1.311 -1.08 0 CA-C-N 115.63 -0.714 . . . . 2.5 111.045 -171.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo . . . . . 0 CA--C 1.513 -0.536 0 C-N-CA 123.0 2.467 . . . . 1.8700000000000001 112.707 -177.962 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.577 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 58.3 m-70 . . . . . 0 C--O 1.216 -0.661 0 N-CA-C 109.677 -0.49 . . . . 0.71999999999999997 109.677 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.578 ' CB ' ' HG2' ' A' ' 61' ' ' ARG . 14.5 ttm -106.43 120.69 42.55 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 119.768 -0.773 . . . . 0.27000000000000002 110.738 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.434 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.9 m-85 -111.46 130.62 55.66 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.075 -0.966 . . . . 0.27000000000000002 109.524 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.472 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.15 153.82 27.06 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.358 -0.608 . . . . 1.26 109.358 174.912 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.418 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 17.3 m-85 -131.27 172.93 11.58 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.436 0.636 . . . . 0.32000000000000001 111.915 -174.159 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -109.44 -22.48 11.99 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.623 -1.171 . . . . 2.3799999999999999 110.833 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.452 ' HB2' HG23 ' A' ' 96' ' ' VAL . 17.4 m120 -144.55 134.88 24.36 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.55 0.691 . . . . 1.1000000000000001 111.457 -176.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.438 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.2 mmm180 -59.32 -40.32 85.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.533 -1.212 . . . . 3.0899999999999999 112.593 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.464 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 28.8 m -62.21 -34.97 77.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.79 0.329 . . . . 0.34999999999999998 110.758 -178.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 100' ' ' ILE . 17.3 t -66.17 -57.1 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.415 0 CA-C-N 116.308 -0.406 . . . . 0.23000000000000001 110.476 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.525 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.4 ptp -58.22 -40.23 81.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.034 -0.53 . . . . 0.17000000000000001 111.016 -177.351 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 102' ' ' MET . 26.1 t70 -65.7 -41.38 92.43 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.418 -0.513 . . . . 0.34000000000000002 110.086 178.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 95' ' ' THR . 1.7 t-20 -68.3 -44.3 75.75 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.178 0.299 . . . . 1.3600000000000001 111.336 -179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.663 HG22 HD11 ' A' ' 104' ' ' LEU . 30.6 mm -61.51 -56.95 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 N-CA-C 108.684 -0.858 . . . . 0.12 108.684 178.098 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.788 ' HA ' HD12 ' A' ' 104' ' ' LEU . 30.6 ttpt -50.08 -49.94 49.73 Favored 'General case' 0 C--O 1.217 -0.632 0 O-C-N 124.052 0.845 . . . . 0.79000000000000004 109.821 176.589 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.576 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 49.9 ttp -49.26 -53.33 22.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.406 -0.815 . . . . 0.28000000000000003 111.289 178.014 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.689 ' O ' HG13 ' A' ' 107' ' ' ILE . 20.7 m -61.03 -54.93 38.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.178 -0.464 . . . . 0.17999999999999999 110.378 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.914 HD13 HD21 ' A' ' 62' ' ' LEU . 23.6 mt -46.72 -53.73 11.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.275 -0.875 . . . . 0.089999999999999997 110.646 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.582 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.9 mt-30 -51.97 -43.08 63.4 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.715 -1.129 . . . . 1.2 112.397 177.289 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 102' ' ' MET . 24.7 mm-40 -70.63 -30.11 66.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.736 0.779 . . . . 2.3700000000000001 109.897 -178.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.689 HG13 ' O ' ' A' ' 103' ' ' THR . 13.1 mt -75.98 -47.3 32.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 114.582 -1.19 . . . . 0.14999999999999999 111.028 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.637 HD12 HD11 ' A' ' 48' ' ' LEU . 8.5 mt -58.46 -43.09 86.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.968 -0.56 . . . . 0.19 112.444 -176.364 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.625 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 16.5 t -67.53 -17.98 64.86 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.933 0.346 . . . . 1.1399999999999999 111.933 -174.096 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -61.22 -31.95 71.73 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.499 -0.926 . . . . 1.6399999999999999 108.499 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.458 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 15.4 m-85 -105.59 12.99 30.6 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.607 -1.179 . . . . 0.65000000000000002 109.884 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.625 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 5.2 mmpt? . . . . . 0 C--N 1.324 -0.52 0 N-CA-C 108.631 -0.878 . . . . 0.76000000000000001 108.631 171.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.509 ' CD2' HG21 ' A' ' 103' ' ' THR . 27.2 m80 . . . . . 0 CA--C 1.516 -0.332 0 N-CA-C 110.261 -0.274 . . . . 0.75 110.261 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.1 t -156.03 155.76 33.22 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 119.981 -0.687 . . . . 1.0900000000000001 112.411 -172.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.48 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -176.07 -163.84 29.32 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 110.523 -1.031 . . . . 0.16 110.523 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.9 130.08 46.05 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 117.308 0.554 . . . . 0.16 110.533 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.488 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -140.26 143.33 35.89 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.955 0.407 . . . . 0.11 111.548 -178.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.547 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 97.3 mt -106.89 109.24 27.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.076 -0.511 . . . . 0.33000000000000002 110.124 176.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -110.19 137.97 47.2 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.533 -0.914 . . . . 0.35999999999999999 108.533 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 53.59 25.84 5.21 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 122.705 0.402 . . . . 0.80000000000000004 111.154 -176.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt 69.52 5.08 4.98 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.521 0.563 . . . . 2.1099999999999999 112.521 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.432 HG13 ' CH2' ' A' ' 29' ' ' TRP . 2.2 p -94.28 120.53 43.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 107.809 -1.182 . . . . 0.22 107.809 167.602 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.478 ' HA ' HG12 ' A' ' 8' ' ' ILE . 78.3 p -73.04 142.83 47.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.291 -0.413 . . . . 1.0700000000000001 110.762 -175.082 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -163.07 -163.77 16.53 Favored Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.506 -0.854 . . . . 0.11 112.672 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.9 mm -123.41 133.85 67.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 109.293 -0.632 . . . . 0.13 109.293 -179.056 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.596 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.84 135.2 41.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 110.103 -0.332 . . . . 0.13 110.103 -176.257 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.45 129.99 29.81 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.693 0.282 . . . . 0.10000000000000001 111.254 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.445 HD13 ' HB ' ' A' ' 103' ' ' THR . 47.6 mt -85.89 132.86 30.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.478 0.656 . . . . 0.27000000000000002 110.439 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -102.82 104.92 15.23 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.748 -1.115 . . . . 1.24 111.064 -173.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -118.42 170.2 9.12 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.146 -0.687 . . . . 1.2 109.146 176.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.0 t70 79.26 -3.8 2.11 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 122.326 1.06 . . . . 0.57999999999999996 109.557 -176.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 23' ' ' SER . 30.2 m -102.99 -173.1 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-N 113.832 -1.531 . . . . 0.25 109.427 178.207 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.634 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.1 p -73.56 169.39 18.59 Favored Pre-proline 0 C--N 1.316 -0.858 0 N-CA-C 105.585 -2.006 . . . . 1.1299999999999999 105.585 175.095 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.422 ' O ' HG13 ' A' ' 41' ' ' VAL . 74.5 Cg_exo -40.83 129.42 2.78 Favored 'Trans proline' 0 C--N 1.358 1.073 0 CA-C-N 121.486 1.566 . . . . 0.16 112.628 -143.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.55 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -54.22 144.03 21.26 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 114.166 -1.379 . . . . 0.10000000000000001 112.158 -162.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -125.25 168.83 12.94 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.497 -1.229 . . . . 0.32000000000000001 111.864 -169.472 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.819 ' HB3' HG22 ' A' ' 40' ' ' VAL . 2.8 tm? -118.32 106.45 12.78 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 107.592 -1.262 . . . . 0.089999999999999997 107.592 173.443 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.1 m -103.31 106.95 17.58 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 120.904 0.383 . . . . 0.17000000000000001 111.027 -175.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.437 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 85.0 t90 -85.16 131.76 34.39 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.859 -0.793 . . . . 0.14000000000000001 108.859 172.024 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 65.1 mtt180 -126.24 159.59 32.61 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.287 -0.634 . . . . 1.9099999999999999 109.287 174.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.8 p -67.51 176.09 2.53 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.013 -0.736 . . . . 0.59999999999999998 109.013 177.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.9 p -59.59 -41.75 90.98 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.659 -0.65 . . . . 0.26000000000000001 111.013 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -82.82 -31.67 28.01 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.272 -0.64 . . . . 2.1200000000000001 109.272 171.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.445 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 101.48 17.22 22.45 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.161 -0.927 . . . . 0.23000000000000001 113.595 172.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -65.8 -52.04 54.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.203 0.501 . . . . 1.73 109.928 174.017 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.8 tttt -77.01 135.93 38.69 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 109.058 -0.719 . . . . 1.3 109.058 176.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 13.8 p -150.03 135.39 10.75 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 CA-C-O 120.91 0.386 . . . . 0.17000000000000001 111.137 -175.038 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -141.96 127.0 18.38 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.458 -0.571 . . . . 0.40999999999999998 109.458 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 29.2 m -115.64 131.72 56.85 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.139 0.422 . . . . 0.14999999999999999 112.139 -172.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.819 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -99.98 129.9 49.94 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 N-CA-C 107.851 -1.166 . . . . 0.12 107.851 168.422 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 45' ' ' ILE . 97.3 t -93.01 121.29 43.59 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 O-C-N 121.148 -0.97 . . . . 0.11 108.577 173.188 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.482 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.52 -17.11 64.09 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.564 0.579 . . . . 0.080000000000000002 112.564 -170.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.558 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 97.7 p -68.5 -19.49 64.54 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.964 -0.754 . . . . 0.87 108.964 174.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.7 p -109.21 15.55 23.12 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.897 -1.047 . . . . 0.14999999999999999 109.994 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.512 HD13 ' HA2' ' A' ' 64' ' ' GLY . 22.2 mm -114.62 141.38 31.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.402 -0.592 . . . . 0.12 109.402 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -102.01 -47.91 4.41 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.799 -0.637 . . . . 0.52000000000000002 110.648 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.701 ' O ' HD23 ' A' ' 48' ' ' LEU . 7.8 mtmm -141.86 169.56 17.35 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 120.599 0.238 . . . . 1.4099999999999999 111.337 -177.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.93 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -141.26 154.34 45.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.72 -0.845 . . . . 0.72999999999999998 108.72 175.856 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.624 ' HG3' HD11 ' A' ' 63' ' ' ILE . 23.5 mt-30 -135.74 145.55 46.74 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 109.365 -0.606 . . . . 1.9399999999999999 109.365 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.475 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -137.92 134.74 35.34 Favored 'General case' 0 C--N 1.319 -0.746 0 O-C-N 121.726 -0.609 . . . . 0.22 110.672 175.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.454 HG21 ' HB3' ' A' ' 57' ' ' LYS . 68.8 p -59.99 119.08 38.4 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.801 -0.636 . . . . 0.26000000000000001 110.704 -177.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.485 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 17.4 Cg_exo -57.21 162.19 9.97 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.664 2.242 . . . . 0.38 111.948 177.032 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.8 -19.6 64.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.084 -0.507 . . . . 0.66000000000000003 110.899 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 45.7 t -82.59 -18.15 42.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.921 -0.581 . . . . 1.5 110.594 176.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.485 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 48.1 m -76.09 137.8 40.37 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.84999999999999998 111.057 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.577 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 39.8 mt-10 -52.38 -35.38 51.42 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 122.038 0.923 . . . . 1.77 109.987 173.652 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.577 ' HD2' ' HB2' ' A' ' 56' ' ' GLU . 10.6 mptt -82.09 158.06 23.86 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.112 -1.404 . . . . 1.6299999999999999 112.984 -169.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.403 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.3 OUTLIER -130.68 96.65 4.15 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.585 -1.189 . . . . 1.1100000000000001 108.485 169.295 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.464 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.2 OUTLIER -155.16 154.43 32.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.237 0.541 . . . . 0.22 111.55 -173.799 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -131.0 120.68 23.84 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.452 -0.944 . . . . 0.10000000000000001 108.452 177.413 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.586 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 14.1 mtp180 -104.6 145.11 30.78 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.036 0.446 . . . . 2.9900000000000002 111.743 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.939 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -122.43 106.69 11.27 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.31 -0.859 . . . . 0.13 109.587 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.624 HD11 ' HG3' ' A' ' 49' ' ' GLN . 1.9 mp -85.19 99.39 7.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 C-N-CA 122.484 0.314 . . . . 0.28999999999999998 110.211 -174.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.512 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -72.57 145.13 36.65 Favored Glycine 0 C--O 1.221 -0.689 0 C-N-CA 120.971 -0.633 . . . . 0.54000000000000004 112.587 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.414 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 89.2 mttt . . . . . 0 C--N 1.318 -0.768 0 C-N-CA 122.692 0.397 . . . . 0.55000000000000004 111.16 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.71 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 26.3 t70 . . . . . 0 C--O 1.218 -0.578 0 N-CA-C 108.469 -0.937 . . . . 3.23 108.469 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -64.84 -4.68 4.69 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.702 0.63 . . . . 2.3900000000000001 112.702 -169.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.6 p -77.49 -4.04 43.52 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.08 0.467 . . . . 2.96 110.524 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.71 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -85.2 30.39 0.6 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.907 -0.588 . . . . 2.4900000000000002 110.669 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.451 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 20.0 mtmt -46.82 114.81 0.9 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.262 0.553 . . . . 3.3999999999999999 110.269 -174.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 55.6 ttt180 -89.11 168.62 12.18 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.611 -0.885 . . . . 3.7999999999999998 108.611 -169.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.633 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 58.1 mttp -131.13 140.08 49.92 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 118.298 0.499 . . . . 4.29 110.625 174.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 75' ' ' ASN . 9.1 t70 -83.61 -173.07 4.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.763 -0.653 . . . . 4.4100000000000001 110.323 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASN . . . . . 0.402 ' H ' ' CG ' ' A' ' 74' ' ' ASP . 29.7 m-80 -59.56 -31.63 69.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.212 0.53 . . . . 5.3399999999999999 110.853 -177.07 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -87.35 1.43 53.34 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.969 -0.56 . . . . 5.3799999999999999 110.789 -177.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.26 7.74 84.59 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.753 -0.737 . . . . 4.3700000000000001 111.681 -175.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.633 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 51.1 m-20 -57.4 128.32 36.45 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 110.186 -0.301 . . . . 4.5099999999999998 110.186 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -73.59 90.12 1.76 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.676 -0.491 . . . . 4.2800000000000002 109.676 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.439 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 11.1 m -103.24 98.47 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-O 122.026 0.917 . . . . 3.1000000000000001 109.618 -178.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.489 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.2 p -88.1 119.78 70.47 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-N 115.57 -0.741 . . . . 2.5 109.736 -178.164 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 31.4 Cg_exo . . . . . 0 CA--C 1.51 -0.712 0 C-N-CA 122.881 2.387 . . . . 1.8700000000000001 112.588 -173.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.593 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 66.0 m80 . . . . . 0 C--O 1.216 -0.661 0 N-CA-C 107.695 -1.224 . . . . 0.71999999999999997 107.695 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.586 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 26.3 ttm -141.87 129.52 21.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 119.183 0.901 . . . . 0.27000000000000002 111.77 174.384 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.488 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 4.7 m-85 -118.4 129.38 55.38 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.361 -0.836 . . . . 0.27000000000000002 109.527 178.242 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.547 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.03 153.13 27.57 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 121.996 -0.44 . . . . 1.26 110.526 177.217 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.428 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.0 m-85 -133.59 172.53 12.62 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 0.32000000000000001 111.133 -175.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -119.26 -11.58 9.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.567 -0.742 . . . . 2.3799999999999999 109.804 177.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.513 ' HB2' HG23 ' A' ' 96' ' ' VAL . 41.5 m-80 -142.66 131.01 22.2 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.212 0.53 . . . . 1.1000000000000001 110.633 -177.437 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.498 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.5 mmm180 -64.62 -34.2 77.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.196 -0.911 . . . . 3.0899999999999999 111.938 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.2 m -62.75 -36.23 82.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.883 0.373 . . . . 0.34999999999999998 110.824 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.566 ' O ' HG12 ' A' ' 100' ' ' ILE . 10.5 t -67.71 -56.11 14.41 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.399 0 CA-C-N 116.074 -0.512 . . . . 0.23000000000000001 110.306 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.581 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.8 ptp -58.45 -37.83 76.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.088 -0.505 . . . . 0.17000000000000001 111.041 -177.102 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -70.09 -26.25 63.89 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.973 -0.291 . . . . 0.34000000000000002 111.085 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -85.93 -39.65 16.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.312 -0.403 . . . . 1.3600000000000001 111.034 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.66 HG22 HD11 ' A' ' 104' ' ' LEU . 29.0 mm -64.98 -56.44 15.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 108.729 -0.841 . . . . 0.12 108.729 176.362 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.686 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.0 ttpt -48.31 -47.75 36.41 Favored 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 123.894 0.746 . . . . 0.79000000000000004 110.161 175.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.724 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 36.2 ttp -50.89 -60.44 3.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.186 -0.915 . . . . 0.28000000000000003 111.084 178.111 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.757 ' O ' HG13 ' A' ' 107' ' ' ILE . 86.6 m -55.95 -53.84 52.03 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 123.49 0.494 . . . . 0.17999999999999999 110.75 -178.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.939 HD13 HD21 ' A' ' 62' ' ' LEU . 25.8 mt -46.54 -58.03 4.17 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.694 0.621 . . . . 0.089999999999999997 110.261 176.051 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.529 ' HG3' HD12 ' A' ' 48' ' ' LEU . 70.4 mt-30 -52.69 -44.56 66.36 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.303 -0.862 . . . . 1.2 112.511 175.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.724 ' HG3' ' O ' ' A' ' 102' ' ' MET . 48.3 mt-30 -62.07 -30.65 71.13 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.709 0.766 . . . . 2.3700000000000001 109.659 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.757 HG13 ' O ' ' A' ' 103' ' ' THR . 6.4 mt -81.75 -41.1 18.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 114.688 -1.142 . . . . 0.14999999999999999 111.297 -177.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.778 HD11 HD21 ' A' ' 48' ' ' LEU . 5.2 mt -60.27 -42.2 89.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 112.948 0.721 . . . . 0.19 112.948 -174.606 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.648 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 2.1 p -65.81 -16.35 63.72 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.573 -0.451 . . . . 1.1399999999999999 112.159 -175.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -63.06 -28.27 69.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.637 0.732 . . . . 1.6399999999999999 109.096 169.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.558 ' CG ' ' HA ' ' A' ' 43' ' ' SER . 29.0 m-85 -110.41 10.83 23.32 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.95 -1.023 . . . . 0.65000000000000002 110.309 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.648 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 9.2 mmpt? . . . . . 0 CA--C 1.511 -0.535 0 N-CA-C 108.648 -0.871 . . . . 0.76000000000000001 108.648 171.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.442 ' CD2' HG21 ' A' ' 103' ' ' THR . 50.8 m80 . . . . . 0 CA--C 1.517 -0.316 0 N-CA-C 110.341 -0.244 . . . . 0.75 110.341 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 43.3 t -157.05 157.6 34.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.544 0.687 . . . . 1.0900000000000001 112.409 -172.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.528 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.39 -167.16 37.0 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 109.813 -1.315 . . . . 0.16 109.813 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -93.73 135.62 34.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 118.008 0.904 . . . . 0.16 110.583 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.502 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -146.78 142.14 27.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.074 -0.512 . . . . 0.11 111.376 -177.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.789 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.0 mt -98.95 128.25 50.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 110.193 -0.299 . . . . 0.33000000000000002 110.193 174.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.482 ' HE2' ' ND1' ' A' ' 38' ' ' HIS . 10.7 t80 -135.19 140.48 45.36 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.756 -0.831 . . . . 0.35999999999999999 108.756 175.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 60.63 24.27 14.04 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.451 0.469 . . . . 0.80000000000000004 109.87 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt 69.49 -2.75 1.81 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.018 0.927 . . . . 2.1099999999999999 113.109 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -92.31 123.68 44.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 108.766 -0.828 . . . . 0.22 108.766 170.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.3 m -74.86 145.38 42.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.325 -0.398 . . . . 1.0700000000000001 110.362 -176.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.01 -158.53 10.15 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 119.869 -1.158 . . . . 0.11 113.497 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.4 mm -125.3 131.5 72.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.456 -0.572 . . . . 0.13 109.456 -177.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.544 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -101.55 136.15 34.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 110.005 -0.369 . . . . 0.13 110.005 -177.297 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.49 131.31 31.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.608 0.242 . . . . 0.10000000000000001 111.39 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.41 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 54.7 mt -86.21 138.41 19.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 121.211 0.529 . . . . 0.27000000000000002 110.403 176.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -109.83 105.23 14.36 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.928 -1.033 . . . . 1.24 111.246 -175.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.437 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 36.5 mt-10 -116.99 170.35 8.7 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.902 -0.777 . . . . 1.2 108.902 175.282 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.437 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 36.3 t70 78.58 -5.01 2.09 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.38 1.086 . . . . 0.57999999999999996 109.777 -177.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 23' ' ' SER . 31.1 m -102.62 -173.33 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 CA-C-N 113.872 -1.513 . . . . 0.25 109.824 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.649 ' O ' HG23 ' A' ' 22' ' ' VAL . 48.2 m -72.78 167.33 34.56 Favored Pre-proline 0 C--N 1.315 -0.914 0 N-CA-C 105.322 -2.103 . . . . 1.1299999999999999 105.322 174.129 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -41.49 127.62 3.28 Favored 'Trans proline' 0 C--N 1.352 0.736 0 CA-C-N 121.13 1.439 . . . . 0.16 112.534 -142.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.474 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -49.64 140.25 11.41 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 113.919 -1.491 . . . . 0.10000000000000001 112.434 -165.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -125.43 169.48 12.34 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 114.09 -1.414 . . . . 0.32000000000000001 111.585 -168.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.794 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -118.89 105.64 11.7 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 107.612 -1.255 . . . . 0.089999999999999997 107.612 173.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 m -100.67 106.48 17.94 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-O 120.973 0.416 . . . . 0.17000000000000001 110.743 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.3 t90 -85.01 132.02 34.39 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.91 -0.774 . . . . 0.14000000000000001 108.91 171.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.503 ' HG2' HG23 ' A' ' 37' ' ' VAL . 93.6 mtt180 -126.0 159.74 31.89 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.258 -0.645 . . . . 1.9099999999999999 109.258 174.015 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 p -70.71 177.68 3.44 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 110.077 -0.342 . . . . 0.59999999999999998 110.077 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 p -64.79 -23.19 67.16 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.398 -0.521 . . . . 0.26000000000000001 111.479 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -99.4 -31.63 11.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.644 0.735 . . . . 2.1200000000000001 109.054 169.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.466 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 98.49 16.59 31.39 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 114.712 -1.131 . . . . 0.23000000000000001 112.153 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -67.19 -39.63 86.4 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.263 -0.643 . . . . 1.73 109.263 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.8 tttm -93.68 141.21 28.74 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.412 -0.959 . . . . 1.3 108.412 175.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.503 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.1 p -147.31 136.89 16.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 120.963 0.411 . . . . 0.17000000000000001 111.007 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.482 ' ND1' ' HE2' ' A' ' 9' ' ' PHE . 3.3 t60 -143.67 118.07 9.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.275 -0.421 . . . . 0.40999999999999998 109.941 -178.102 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 24.7 m -110.79 133.79 53.05 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.409 0.522 . . . . 0.14999999999999999 112.409 -173.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.794 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.63 130.24 54.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 N-CA-C 108.103 -1.073 . . . . 0.12 108.103 168.543 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 90.4 t -93.34 120.4 42.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 O-C-N 121.202 -0.936 . . . . 0.11 108.754 173.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.553 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -68.14 -19.4 64.81 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.231 0.826 . . . . 0.080000000000000002 113.231 -169.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.564 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 9.8 p -70.2 -13.45 62.19 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.336 0.589 . . . . 0.87 109.641 175.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.4 p -108.66 11.28 26.63 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.477 -0.783 . . . . 0.14999999999999999 109.583 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.531 HG21 ' CD1' ' A' ' 62' ' ' LEU . 26.3 mm -113.83 144.68 20.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.102 -0.703 . . . . 0.12 109.102 178.593 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -110.77 -41.79 4.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.78 0.324 . . . . 0.52000000000000002 110.968 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.528 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 14.9 mtmt -140.33 174.39 10.56 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.106 0.479 . . . . 1.4099999999999999 111.029 -179.391 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.595 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -152.49 134.73 15.04 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.673 -0.862 . . . . 0.72999999999999998 108.673 -178.106 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -133.45 115.19 14.5 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 122.268 -0.27 . . . . 1.9399999999999999 111.289 -170.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.457 ' HB2' ' HG ' ' A' ' 60' ' ' LEU . . . -114.8 146.67 40.77 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.179 -0.326 . . . . 0.22 111.802 -175.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.42 ' CG2' ' HB2' ' A' ' 59' ' ' MET . 80.5 p -72.44 120.91 83.15 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 115.922 -0.581 . . . . 0.26000000000000001 110.921 -176.639 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.604 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 10.0 Cg_exo -62.3 165.96 13.98 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.832 2.355 . . . . 0.38 111.921 175.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.89 -27.25 67.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.042 -0.526 . . . . 0.66000000000000003 111.313 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.5 m -84.91 -4.84 59.28 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.87 -0.605 . . . . 1.5 110.772 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.604 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 35.2 m -82.64 148.53 27.91 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.03 -0.532 . . . . 0.84999999999999998 111.635 178.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -70.52 7.04 1.17 Allowed 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.169 -0.923 . . . . 1.77 111.909 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.475 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 40.7 mmtm -130.26 153.3 48.76 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 115.171 -0.922 . . . . 1.6299999999999999 111.204 -167.265 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.462 ' O ' ' HG3' ' A' ' 59' ' ' MET . 80.1 mmm -125.61 97.23 5.08 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.565 -0.902 . . . . 1.1100000000000001 108.565 167.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.475 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.28 156.32 35.33 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.242 0.544 . . . . 0.22 111.983 -172.538 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.54 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.3 tt -135.17 118.88 17.11 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.435 -0.95 . . . . 0.10000000000000001 108.435 177.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.736 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.2 mtp180 -101.85 144.6 30.3 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.342 0.591 . . . . 2.9900000000000002 111.748 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.899 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -120.24 110.19 16.29 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.776 -1.102 . . . . 0.13 108.863 178.085 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.492 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.4 mp -88.88 100.91 11.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.135 0.493 . . . . 0.28999999999999998 110.475 -172.191 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.448 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -71.22 141.02 31.91 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.652 -0.704 . . . . 0.54000000000000004 112.615 -177.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.461 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 79.7 mttt . . . . . 0 C--N 1.318 -0.763 0 N-CA-C 112.992 0.738 . . . . 0.55000000000000004 112.992 -174.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.505 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 5.3 m-20 . . . . . 0 C--O 1.215 -0.751 0 N-CA-C 108.687 -0.856 . . . . 3.23 108.687 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 43.1 mt-10 -65.02 -2.58 2.8 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.606 0.241 . . . . 2.3900000000000001 111.618 -175.384 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . 0.422 ' C ' ' H ' ' A' ' 71' ' ' LYS . 12.9 p -69.6 -13.26 62.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.388 0.613 . . . . 2.96 109.761 169.191 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.543 ' NZ ' ' HG2' ' A' ' 82' ' ' PRO . 13.6 ptmm? -75.34 29.69 0.1 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.164 -0.926 . . . . 2.4900000000000002 110.797 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 20.0 mtmt -48.09 114.66 0.97 Allowed 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.369 0.604 . . . . 3.3999999999999999 109.835 -174.492 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.528 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 79.3 ttt180 -92.91 165.65 12.78 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 114.976 -1.011 . . . . 3.7999999999999998 108.838 -171.333 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.42 ' HD3' ' O ' ' A' ' 77' ' ' GLY . 54.9 mttp -127.11 139.34 53.05 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.302 0.572 . . . . 4.29 109.919 171.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.432 ' CG ' ' H ' ' A' ' 75' ' ' ASN . 13.7 t70 -91.79 -165.33 1.33 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.175 -0.92 . . . . 4.4100000000000001 110.368 -174.471 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASN . . . . . 0.432 ' H ' ' CG ' ' A' ' 74' ' ' ASP . 78.9 m-20 -62.71 -33.17 74.56 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.375 0.509 . . . . 5.3399999999999999 112.375 -169.11 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -84.28 1.62 43.97 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 111.67 0.248 . . . . 5.3799999999999999 111.67 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.42 ' O ' ' HD3' ' A' ' 73' ' ' LYS . . . 79.72 4.33 89.34 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.55 -0.833 . . . . 4.3700000000000001 111.422 -175.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -72.01 140.49 49.09 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.921 -0.4 . . . . 4.5099999999999998 109.921 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -68.98 116.87 9.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.105 -0.498 . . . . 4.2800000000000002 110.879 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 9.8 m -122.47 98.85 6.13 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 108.877 -0.786 . . . . 3.1000000000000001 108.877 173.021 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 1.2 p -86.31 109.94 27.34 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-O 121.235 0.541 . . . . 2.5 110.126 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.543 ' HG2' ' NZ ' ' A' ' 70' ' ' LYS . 52.5 Cg_exo . . . . . 0 CA--C 1.513 -0.547 0 C-N-CA 123.549 2.833 . . . . 1.8700000000000001 112.279 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.515 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 56.9 m80 . . . . . 0 C--O 1.219 -0.527 0 N-CA-C 106.954 -1.499 . . . . 0.71999999999999997 106.954 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.736 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 15.6 ttm -140.09 125.98 19.54 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 119.403 1.001 . . . . 0.27000000000000002 111.814 175.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.473 ' O ' ' HA ' ' A' ' 59' ' ' MET . 15.8 m-85 -108.12 158.07 17.74 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.965 -1.016 . . . . 0.27000000000000002 108.72 176.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.789 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -106.69 157.6 17.59 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 108.806 -0.812 . . . . 1.26 108.806 175.455 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.54 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 30.9 m-85 -139.39 170.46 15.88 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.011 0.434 . . . . 0.32000000000000001 111.615 -176.453 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -123.86 -5.78 7.98 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.593 -0.731 . . . . 2.3799999999999999 110.379 176.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.43 ' HB2' HG23 ' A' ' 96' ' ' VAL . 20.0 m120 -147.13 126.15 12.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.041 -0.527 . . . . 1.1000000000000001 109.918 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.631 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 13.8 mmm180 -61.52 -35.4 77.62 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 116.011 -0.541 . . . . 3.0899999999999999 110.994 177.779 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -56.85 -36.2 69.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.186 -0.461 . . . . 0.34999999999999998 110.423 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.633 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.6 t -69.18 -60.26 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.022 -0.536 . . . . 0.23000000000000001 110.329 176.495 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.631 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.5 ptp -57.93 -40.14 79.71 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 116.578 -0.283 . . . . 0.17000000000000001 110.813 -176.094 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.487 ' N ' ' HG3' ' A' ' 97' ' ' MET . 35.2 t70 -58.92 -44.44 91.31 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.477 -0.489 . . . . 0.34000000000000002 110.381 176.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -72.24 -42.4 65.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.303 -0.408 . . . . 1.3600000000000001 111.927 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.633 HG12 ' O ' ' A' ' 96' ' ' VAL . 27.3 mm -61.94 -56.94 14.49 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 N-CA-C 108.833 -0.802 . . . . 0.12 108.833 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.737 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.7 ttpt -49.43 -52.69 27.22 Favored 'General case' 0 C--O 1.216 -0.683 0 O-C-N 123.934 0.771 . . . . 0.79000000000000004 109.762 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.557 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 39.1 ttp -48.17 -53.28 17.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.121 -0.945 . . . . 0.28000000000000003 111.474 178.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.732 ' O ' HG13 ' A' ' 107' ' ' ILE . 85.6 m -60.64 -54.51 44.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.134 -0.484 . . . . 0.17999999999999999 110.483 178.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.899 HD13 HD21 ' A' ' 62' ' ' LEU . 24.9 mt -47.9 -54.54 12.33 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.782 0.676 . . . . 0.089999999999999997 110.63 177.126 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.567 ' HG2' HD13 ' A' ' 48' ' ' LEU . 94.1 mt-30 -49.02 -49.0 43.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.391 -1.277 . . . . 1.2 111.923 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 102' ' ' MET . 27.6 mm-40 -67.77 -28.38 67.56 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.451 0.643 . . . . 2.3700000000000001 110.556 -177.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.732 HG13 ' O ' ' A' ' 103' ' ' THR . 8.2 mt -75.87 -41.18 39.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-N 115.128 -0.942 . . . . 0.14999999999999999 110.642 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.534 HD12 HD11 ' A' ' 48' ' ' LEU . 7.5 mt -65.16 -40.58 89.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.387 -0.369 . . . . 0.19 111.614 -178.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.2 p -61.02 -18.91 60.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.838 0.351 . . . . 1.1399999999999999 111.517 -177.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -66.58 -48.71 68.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.311 0.577 . . . . 1.6399999999999999 109.443 173.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.564 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 15.4 m-85 -77.48 -22.68 50.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.316 -0.857 . . . . 0.65000000000000002 109.859 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 115.019 -0.991 . . . . 0.76000000000000001 109.911 177.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.515 ' HA ' HD12 ' A' ' 18' ' ' ILE . 41.7 m80 . . . . . 0 CA--C 1.511 -0.546 0 N-CA-C 109.704 -0.48 . . . . 0.75 109.704 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.8 p -158.29 164.68 36.18 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 119.749 -0.78 . . . . 1.0900000000000001 112.648 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.444 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 176.76 -163.75 32.91 Favored Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 114.692 -1.14 . . . . 0.16 110.916 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.83 135.72 43.97 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.677 -0.49 . . . . 0.16 109.677 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.508 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -148.54 143.01 26.36 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.039 0.447 . . . . 0.11 111.756 -175.467 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 13' ' ' SER . 89.1 mt -106.63 124.21 62.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.22 -0.446 . . . . 0.33000000000000002 110.226 177.102 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -127.35 140.75 51.98 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 108.682 -0.858 . . . . 0.35999999999999999 108.682 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 54.36 25.62 6.16 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.636 0.375 . . . . 0.80000000000000004 111.113 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm 65.49 14.44 9.47 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.801 0.667 . . . . 2.1099999999999999 112.801 -177.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.441 HG13 ' CH2' ' A' ' 29' ' ' TRP . 2.1 p -103.97 121.72 55.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 108.428 -0.953 . . . . 0.22 108.428 166.032 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.489 ' HA ' HG12 ' A' ' 8' ' ' ILE . 50.1 p -75.49 144.38 42.05 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.379 -0.373 . . . . 1.0700000000000001 110.85 -175.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.438 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.96 -160.01 10.64 Favored Glycine 0 N--CA 1.437 -1.243 0 C-N-CA 120.256 -0.973 . . . . 0.11 113.527 -177.293 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.7 mm -126.12 132.19 70.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 109.296 -0.631 . . . . 0.13 109.296 -177.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.553 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.37 136.39 34.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 120.684 0.278 . . . . 0.13 110.477 -175.664 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.24 127.26 25.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.92 0.391 . . . . 0.10000000000000001 111.76 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.515 HD12 ' HA ' ' A' ' 3' ' ' HIS . 57.8 mt -86.11 135.51 24.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.757 -0.461 . . . . 0.27000000000000002 109.757 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -110.32 106.72 16.2 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.164 -0.471 . . . . 1.24 110.989 -175.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.442 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 30.4 mt-10 -117.35 170.25 8.86 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.848 -0.797 . . . . 1.2 108.848 174.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.442 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 34.6 t70 78.04 -3.98 2.28 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 122.342 1.068 . . . . 0.57999999999999996 109.737 -176.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' ' 23' ' ' SER . 32.9 m -103.09 -174.07 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-N 113.96 -1.473 . . . . 0.25 109.651 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.598 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.8 m -72.35 164.66 57.78 Favored Pre-proline 0 C--N 1.316 -0.868 0 N-CA-C 104.997 -2.223 . . . . 1.1299999999999999 104.997 174.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.408 ' O ' HG13 ' A' ' 41' ' ' VAL . 82.2 Cg_exo -41.45 128.79 3.46 Favored 'Trans proline' 0 C--N 1.353 0.785 0 CA-C-N 120.949 1.374 . . . . 0.16 112.744 -141.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -47.66 141.3 5.46 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 113.919 -1.491 . . . . 0.10000000000000001 112.703 -165.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -127.71 164.7 21.54 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 114.382 -1.281 . . . . 0.32000000000000001 111.731 -169.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.719 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -115.48 105.44 12.81 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 107.55 -1.278 . . . . 0.089999999999999997 107.55 173.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.0 m -100.39 106.71 18.33 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 120.941 0.4 . . . . 0.17000000000000001 110.57 -176.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.441 ' CH2' HG13 ' A' ' 12' ' ' VAL . 82.7 t90 -84.67 131.72 34.55 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.801 -0.815 . . . . 0.14000000000000001 108.801 172.573 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.561 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 36.8 mtm180 -122.66 160.86 24.93 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.824 -0.806 . . . . 1.9099999999999999 108.824 175.455 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -72.38 178.1 4.18 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.995 -0.743 . . . . 0.59999999999999998 108.995 175.442 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.438 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 5.1 p -60.43 -31.25 70.23 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.307 -0.557 . . . . 0.26000000000000001 111.046 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -94.6 -24.27 17.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.785 0.802 . . . . 2.1200000000000001 109.686 172.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.561 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 88.32 16.76 58.48 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 114.762 -1.108 . . . . 0.23000000000000001 111.591 -178.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -65.69 -41.43 92.39 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.052 -0.722 . . . . 1.73 109.052 175.285 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.6 tttt -91.98 140.86 29.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.03 -0.987 . . . . 1.3 108.361 171.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.482 HG23 ' HG2' ' A' ' 30' ' ' ARG . 11.1 p -148.48 135.96 13.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.812 0.339 . . . . 0.17000000000000001 110.639 -178.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -143.65 124.99 14.65 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.966 -0.383 . . . . 0.40999999999999998 109.966 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.3 m -110.81 141.14 44.55 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.144 0.424 . . . . 0.14999999999999999 112.144 -173.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.719 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -111.09 129.22 66.76 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 N-CA-C 108.037 -1.097 . . . . 0.12 108.037 168.163 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.46 ' O ' HG12 ' A' ' 45' ' ' ILE . 94.3 t -93.01 121.41 43.68 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 O-C-N 120.991 -1.068 . . . . 0.11 108.973 173.347 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.572 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -68.75 -21.22 64.38 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.098 0.777 . . . . 0.080000000000000002 113.098 -169.319 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 p -68.23 -15.98 63.79 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.383 0.611 . . . . 0.87 109.386 175.173 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.482 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 5.1 p -111.18 14.29 21.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.395 -0.82 . . . . 0.14999999999999999 110.079 -178.763 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.559 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.3 mm -112.41 139.05 39.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.961 -0.755 . . . . 0.12 108.961 177.182 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -105.23 -43.84 4.91 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.181 -0.463 . . . . 0.52000000000000002 110.586 -175.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 26.7 mtpt -133.07 169.09 17.34 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 121.334 0.588 . . . . 1.4099999999999999 111.292 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.898 HD11 HD12 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -150.77 146.34 26.33 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.909 -1.041 . . . . 0.72999999999999998 108.998 176.57 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.681 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 11.6 mm-40 -134.5 145.23 48.59 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.979 -0.378 . . . . 1.9399999999999999 109.979 -173.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.593 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -142.12 132.69 25.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 118.135 0.425 . . . . 0.22 111.032 174.136 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.46 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 82.6 p -64.98 118.03 45.03 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.508 -0.769 . . . . 0.26000000000000001 110.704 -176.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -54.86 160.23 7.99 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 123.057 2.505 . . . . 0.38 112.34 177.074 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.03 -12.87 61.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.06 -0.518 . . . . 0.66000000000000003 111.438 -178.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.9 m -89.16 -19.23 25.73 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.219 0.533 . . . . 1.5 110.558 174.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.9 m -72.57 141.3 48.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.553 -0.749 . . . . 0.84999999999999998 111.005 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.5 -6.42 19.55 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.408 -0.815 . . . . 1.77 111.151 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.425 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 9.0 mptt -107.65 159.81 16.18 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.957 -1.02 . . . . 1.6299999999999999 111.716 -175.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.46 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 3.1 mtp -131.91 98.3 4.41 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 114.636 -1.165 . . . . 1.1100000000000001 108.778 168.657 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.446 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.1 OUTLIER -154.89 155.36 34.19 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.727 -0.67 . . . . 0.22 112.15 -172.364 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.511 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -135.11 119.05 17.36 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.659 -1.155 . . . . 0.10000000000000001 108.302 177.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.7 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 6.4 mtp180 -104.25 138.04 41.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.232 0.539 . . . . 2.9900000000000002 111.171 -178.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.922 HD21 HD13 ' A' ' 104' ' ' LEU . 1.6 mm? -115.9 106.02 13.34 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.34 -0.845 . . . . 0.13 109.252 176.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.497 HD12 ' N ' ' A' ' 63' ' ' ILE . 3.0 mp -88.67 108.33 18.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 110.318 -0.253 . . . . 0.28999999999999998 110.318 -173.6 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.408 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -63.58 157.82 40.81 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.135 -0.555 . . . . 0.54000000000000004 112.659 179.14 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 82.8 mttt . . . . . 0 C--N 1.321 -0.672 0 CA-C-O 121.018 0.437 . . . . 0.55000000000000004 111.184 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.446 ' HB2' ' HD2' ' A' ' 70' ' ' LYS . 23.8 m-20 . . . . . 0 N--CA 1.445 -0.717 0 N-CA-C 108.156 -1.053 . . . . 3.23 108.156 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -70.26 -2.84 14.56 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.249 0.547 . . . . 2.3900000000000001 111.044 -174.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.3 p -91.37 -3.72 56.46 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.621 -0.718 . . . . 2.96 110.601 173.539 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 8.5 ptmm? -83.19 27.89 0.55 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.206 -0.452 . . . . 2.4900000000000002 110.459 -177.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.544 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 29.3 mmtm -44.86 113.38 0.55 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.542 -0.754 . . . . 3.3999999999999999 110.94 -170.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.527 ' HB3' HG23 ' A' ' 80' ' ' VAL . 72.3 ttt180 -98.04 165.93 11.67 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 108.174 -1.047 . . . . 3.7999999999999998 108.174 178.834 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.595 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 63.1 mttp -134.01 140.83 46.96 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.704 -0.48 . . . . 4.29 109.704 172.57 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.479 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.5 OUTLIER -79.09 -172.07 2.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.642 -0.708 . . . . 4.4100000000000001 110.057 -178.237 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -62.15 -31.84 72.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.616 0.246 . . . . 5.3399999999999999 111.327 -179.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.479 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 26.0 mt-10 -78.79 -31.53 46.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.701 0.286 . . . . 5.3799999999999999 110.798 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 114.65 17.09 7.16 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.786 -0.721 . . . . 4.3700000000000001 112.635 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.595 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 38.1 m-80 -74.07 134.05 42.92 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.571 -0.529 . . . . 4.5099999999999998 109.571 177.192 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -72.01 91.41 1.22 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.568 -0.53 . . . . 4.2800000000000002 109.568 178.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.527 HG23 ' HB3' ' A' ' 72' ' ' ARG . 27.2 m -93.25 100.76 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.902 0 CA-C-O 122.035 0.922 . . . . 3.1000000000000001 109.885 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.544 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.5 p -94.82 106.27 23.75 Favored Pre-proline 0 C--N 1.319 -0.73 0 CA-C-N 115.554 -0.748 . . . . 2.5 109.612 177.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 36.6 Cg_exo . . . . . 0 C--O 1.233 0.23 0 C-N-CA 123.366 2.711 . . . . 1.8700000000000001 113.212 -171.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.568 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 38.2 m80 . . . . . 0 C--O 1.218 -0.562 0 N-CA-C 108.974 -0.75 . . . . 0.71999999999999997 108.974 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.7 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 24.1 ttm -108.27 118.97 38.16 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 119.898 -0.721 . . . . 0.27000000000000002 111.341 -177.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.508 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.3 m-85 -109.53 128.54 55.27 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.2 -0.909 . . . . 0.27000000000000002 109.905 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.473 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.59 151.09 27.83 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 110.038 -0.356 . . . . 1.26 110.038 176.058 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.413 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 20.7 m-85 -130.54 174.43 9.9 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.362 0.601 . . . . 0.32000000000000001 111.69 -173.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -115.42 -19.54 10.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.103 -0.953 . . . . 2.3799999999999999 110.878 177.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.428 ' HB2' HG23 ' A' ' 96' ' ' VAL . 17.3 m120 -142.61 133.56 25.71 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.423 0.63 . . . . 1.1000000000000001 110.926 -178.306 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.504 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.7 mmm180 -61.46 -35.52 77.86 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.713 -1.131 . . . . 3.0899999999999999 112.063 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.9 m -62.85 -34.14 76.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.735 0.302 . . . . 0.34999999999999998 110.775 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.548 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.0 t -69.2 -57.06 9.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.299 -0.41 . . . . 0.23000000000000001 110.328 178.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.511 ' HA ' HD12 ' A' ' 60' ' ' LEU . 12.6 ptp -57.96 -38.69 76.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.056 -0.52 . . . . 0.17000000000000001 111.39 -176.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 97' ' ' MET . 15.6 t70 -67.63 -37.46 82.49 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.996 -0.282 . . . . 0.34000000000000002 110.297 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.467 ' HA ' ' HE2' ' A' ' 102' ' ' MET . 4.2 m-80 -72.56 -43.03 64.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.242 -0.435 . . . . 1.3600000000000001 111.163 178.227 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.655 HG22 HD11 ' A' ' 104' ' ' LEU . 32.4 mm -62.42 -56.62 16.41 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 N-CA-C 108.849 -0.797 . . . . 0.12 108.849 177.247 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.817 ' HA ' HD12 ' A' ' 104' ' ' LEU . 12.3 ttpp -51.34 -46.24 62.6 Favored 'General case' 0 C--O 1.22 -0.481 0 O-C-N 123.693 0.621 . . . . 0.79000000000000004 110.112 177.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.646 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 38.2 ttp -50.3 -59.69 3.72 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.669 -0.696 . . . . 0.28000000000000003 111.175 177.03 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.78 ' O ' HG13 ' A' ' 107' ' ' ILE . 35.5 m -57.39 -52.81 63.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.212 -0.449 . . . . 0.17999999999999999 110.546 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.922 HD13 HD21 ' A' ' 62' ' ' LEU . 26.4 mt -45.8 -55.35 6.7 Favored 'General case' 0 C--O 1.223 -0.336 0 O-C-N 123.685 0.615 . . . . 0.089999999999999997 110.313 174.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.671 ' CG ' HD13 ' A' ' 48' ' ' LEU . 23.7 mt-30 -55.75 -43.93 77.13 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.877 -1.056 . . . . 1.2 112.484 177.247 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.646 ' HG3' ' O ' ' A' ' 102' ' ' MET . 42.2 mt-30 -62.12 -32.43 73.0 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.877 0.846 . . . . 2.3700000000000001 108.862 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.78 HG13 ' O ' ' A' ' 103' ' ' THR . 9.8 mt -78.63 -46.68 24.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 114.284 -1.325 . . . . 0.14999999999999999 111.116 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.898 HD12 HD11 ' A' ' 48' ' ' LEU . 7.9 mt -61.8 -39.52 83.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.074 -0.512 . . . . 0.19 111.675 -177.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.0 t -60.17 -26.82 66.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.653 0.263 . . . . 1.1399999999999999 111.065 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -65.64 -43.82 88.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.537 0.684 . . . . 1.6399999999999999 109.249 174.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -91.53 12.04 22.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.65000000000000002 109.759 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? . . . . . 0 C--N 1.321 -0.641 0 CA-C-N 114.75 -1.113 . . . . 0.76000000000000001 108.118 173.467 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.565 ' HA ' HD12 ' A' ' 18' ' ' ILE . 75.3 m80 . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 111.656 0.243 . . . . 0.75 111.656 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 p -158.68 165.86 33.39 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.085 -0.646 . . . . 1.0900000000000001 112.171 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.499 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 175.57 -165.77 36.78 Favored Glycine 0 N--CA 1.44 -1.081 0 CA-C-N 114.971 -1.013 . . . . 0.16 110.915 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.3 134.1 46.13 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 117.153 0.476 . . . . 0.16 110.009 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.583 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -146.56 148.61 32.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.623 -0.262 . . . . 0.11 111.656 -176.071 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.802 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 61.6 mt -109.39 122.83 64.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.952 0.406 . . . . 0.33000000000000002 110.719 176.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.414 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.3 t80 -125.59 134.16 52.02 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.785 -0.82 . . . . 0.35999999999999999 108.785 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 59.52 26.61 15.62 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.777 0.431 . . . . 0.80000000000000004 110.543 -177.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt 69.56 1.06 3.19 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.825 0.85 . . . . 2.1099999999999999 113.125 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.414 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.5 OUTLIER -92.45 123.77 44.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 108.418 -0.956 . . . . 0.22 108.418 167.842 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.3 m -75.9 145.77 40.24 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.901 0.381 . . . . 1.0700000000000001 110.234 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.6 -160.82 11.17 Favored Glycine 0 N--CA 1.437 -1.297 0 C-N-CA 120.317 -0.944 . . . . 0.11 112.944 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.5 mm -125.28 135.04 65.29 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.217 -0.661 . . . . 0.13 109.217 -178.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.595 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -104.08 135.5 41.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 110.133 -0.321 . . . . 0.13 110.133 -175.493 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.69 129.2 30.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.928 0.394 . . . . 0.10000000000000001 111.594 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.565 HD12 ' HA ' ' A' ' 3' ' ' HIS . 58.5 mt -86.11 134.98 26.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 109.812 -0.44 . . . . 0.27000000000000002 109.812 177.589 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -111.33 103.57 11.97 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.245 -0.434 . . . . 1.24 111.303 -173.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.455 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 30.9 mt-10 -114.95 170.32 8.43 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.435 -0.95 . . . . 1.2 108.435 173.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.455 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.1 t70 80.77 -5.84 1.69 Allowed 'General case' 0 N--CA 1.484 1.225 0 CA-C-O 122.393 1.092 . . . . 0.57999999999999996 109.472 -176.669 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 23' ' ' SER . 26.4 m -102.74 -173.18 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-N 113.732 -1.576 . . . . 0.25 109.107 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.627 ' O ' HG23 ' A' ' 22' ' ' VAL . 30.5 m -72.15 168.12 25.95 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 105.549 -2.019 . . . . 1.1299999999999999 105.549 175.146 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.411 ' O ' HG13 ' A' ' 41' ' ' VAL . 68.8 Cg_exo -40.76 128.36 2.64 Favored 'Trans proline' 0 C--N 1.359 1.095 0 CA-C-N 121.288 1.496 . . . . 0.16 112.518 -145.243 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.517 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -49.24 140.39 9.9 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 114.215 -1.357 . . . . 0.10000000000000001 112.534 -164.042 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.29 166.47 15.84 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.353 -1.294 . . . . 0.32000000000000001 111.862 -170.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.768 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -115.84 107.3 14.85 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 107.633 -1.247 . . . . 0.089999999999999997 107.633 173.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.1 m -104.16 106.94 17.62 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 120.82 0.343 . . . . 0.17000000000000001 111.301 -174.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 86.2 t90 -85.21 130.44 34.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.942 -0.762 . . . . 0.14000000000000001 108.942 172.557 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.454 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 61.4 mtt180 -125.16 156.7 37.98 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 108.77 -0.826 . . . . 1.9099999999999999 108.77 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -66.0 174.47 2.47 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.301 -0.629 . . . . 0.59999999999999998 109.301 178.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.1 p -58.02 -36.92 73.38 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.408 -0.517 . . . . 0.26000000000000001 110.681 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -87.67 -32.26 19.32 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.558 0.694 . . . . 2.1200000000000001 109.716 172.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.454 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 100.29 12.78 37.93 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 114.922 -1.036 . . . . 0.23000000000000001 112.825 176.426 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -66.68 -36.53 82.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.36 0.6 . . . . 1.73 109.895 176.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -95.68 137.82 34.2 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.414 -0.958 . . . . 1.3 108.414 174.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 14.6 p -150.48 136.31 11.54 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-O 120.994 0.426 . . . . 0.17000000000000001 111.391 -177.003 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -143.71 128.8 18.64 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.634 -0.506 . . . . 0.40999999999999998 109.634 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 30.4 m -114.37 140.86 48.31 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.033 0.383 . . . . 0.14999999999999999 112.033 -172.771 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.768 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -107.89 128.97 62.77 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 N-CA-C 108.18 -1.044 . . . . 0.12 108.18 168.383 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 45' ' ' ILE . 99.8 t -92.3 118.78 38.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 121.228 -0.92 . . . . 0.11 108.963 173.507 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.568 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -67.56 -18.55 65.05 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.866 0.691 . . . . 0.080000000000000002 112.866 -170.404 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.537 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 80.4 p -68.18 -18.3 64.56 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.177 -0.675 . . . . 0.87 109.177 176.222 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.9 p -109.99 13.21 23.45 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.886 -1.052 . . . . 0.14999999999999999 110.206 -177.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.554 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 27.4 mm -111.63 140.47 30.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.054 -0.521 . . . . 0.12 109.657 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -106.86 -43.99 4.54 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.882 -0.599 . . . . 0.52000000000000002 110.839 -175.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.537 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 40.4 mtpt -133.57 172.26 12.98 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.411 0.624 . . . . 1.4099999999999999 111.537 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.657 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -151.08 148.95 28.94 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.939 -1.028 . . . . 0.72999999999999998 108.882 174.8 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.515 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 5.4 mm-40 -136.34 153.36 51.16 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.381 -0.6 . . . . 1.9399999999999999 109.381 -176.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.463 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -145.66 140.36 27.24 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 118.278 0.49 . . . . 0.22 110.917 176.243 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 76.2 p -71.08 118.21 63.56 Favored Pre-proline 0 C--O 1.234 0.258 0 CA-C-N 116.134 -0.485 . . . . 0.26000000000000001 111.272 -176.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.466 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 17.4 Cg_exo -56.82 160.69 11.62 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.867 2.378 . . . . 0.38 112.299 177.215 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.56 -20.88 66.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.697 -0.683 . . . . 0.66000000000000003 111.871 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.8 m -85.9 -18.07 33.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.203 0.525 . . . . 1.5 111.067 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.466 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 35.1 m -68.93 143.34 54.48 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.527 -0.76 . . . . 0.84999999999999998 112.263 -177.342 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -58.18 -26.76 63.15 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 114.639 -1.164 . . . . 1.77 110.975 171.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.518 ' HB3' ' HE1' ' A' ' 59' ' ' MET . 68.1 mmtt -91.73 153.05 19.89 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.948 -1.478 . . . . 1.6299999999999999 111.984 -169.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.577 ' O ' ' HG3' ' A' ' 59' ' ' MET . 80.0 mmm -127.16 96.16 4.51 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.317 -0.994 . . . . 1.1100000000000001 108.317 167.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.577 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -158.52 158.34 33.83 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.581 0.705 . . . . 0.22 112.226 -173.326 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.536 HD12 ' HA ' ' A' ' 97' ' ' MET . 2.4 tt -135.43 120.62 18.91 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.662 -1.154 . . . . 0.10000000000000001 108.121 176.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.624 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 1.0 OUTLIER -102.94 146.34 28.47 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.307 0.575 . . . . 2.9900000000000002 111.591 -177.697 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.938 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -125.62 106.18 9.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.847 -1.07 . . . . 0.13 108.952 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.537 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.4 mp -87.73 105.85 15.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-O 120.695 0.283 . . . . 0.28999999999999998 110.532 -172.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.89 147.66 36.93 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.306 -0.474 . . . . 0.54000000000000004 113.062 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.554 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 90.1 mttt . . . . . 0 C--N 1.323 -0.583 0 C-N-CA 122.922 0.489 . . . . 0.55000000000000004 111.945 -178.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.617 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 4.7 m-20 . . . . . 0 C--O 1.221 -0.415 0 N-CA-C 108.835 -0.802 . . . . 3.23 108.835 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.69 -6.34 7.65 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.328 0.492 . . . . 2.3900000000000001 112.328 -172.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.0 p -69.39 -8.45 46.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.387 0.613 . . . . 2.96 110.106 172.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.617 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.2 ptpt -82.92 33.21 0.43 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.489 -0.778 . . . . 2.4900000000000002 111.226 178.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.1 mtmm -46.63 114.21 0.78 Allowed 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.277 -0.638 . . . . 3.3999999999999999 109.277 -177.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.51 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.8 ttt180 -96.65 161.55 13.84 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.012 -0.994 . . . . 3.7999999999999998 109.005 -168.199 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.57 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 98.8 mttt -129.23 146.56 51.11 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 109.669 -0.493 . . . . 4.29 109.669 173.492 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.476 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 1.1 p-10 -81.48 -168.85 2.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.993 -0.549 . . . . 4.4100000000000001 110.52 -177.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -59.37 -32.04 69.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.665 -0.243 . . . . 5.3399999999999999 111.629 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.476 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 16.5 mt-10 -82.67 -41.51 19.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.093 0.473 . . . . 5.3799999999999999 110.648 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 127.12 16.0 2.45 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.737 -0.744 . . . . 4.3700000000000001 112.145 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.57 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 37.1 m-80 -73.11 138.18 45.65 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.63 -0.507 . . . . 4.5099999999999998 109.63 178.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -75.14 93.32 2.77 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.203 -0.453 . . . . 4.2800000000000002 110.401 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.51 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 14.7 m -103.91 99.45 8.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.466 0.65 . . . . 3.1000000000000001 109.309 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.471 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 p -92.41 111.84 52.49 Favored Pre-proline 0 C--N 1.316 -0.889 0 CA-C-O 121.366 0.603 . . . . 2.5 110.655 -177.318 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 39.1 Cg_exo . . . . . 0 N--CA 1.46 -0.472 0 C-N-CA 123.114 2.543 . . . . 1.8700000000000001 112.082 -178.874 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.515 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 65.1 m80 . . . . . 0 C--O 1.22 -0.496 0 N-CA-C 107.217 -1.401 . . . . 0.71999999999999997 107.217 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.624 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 26.6 ttm -141.94 131.84 24.41 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 119.033 0.833 . . . . 0.27000000000000002 111.204 175.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.529 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.5 m-85 -120.97 134.64 55.3 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.471 -0.786 . . . . 0.27000000000000002 109.529 178.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.802 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -79.99 159.39 26.27 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.507 -0.553 . . . . 1.26 109.507 178.071 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 16.7 m-85 -138.4 175.16 9.81 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.349 0.595 . . . . 0.32000000000000001 112.151 -177.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.1 p-10 -116.94 -20.55 9.34 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.111 -0.95 . . . . 2.3799999999999999 110.843 178.566 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -145.87 143.77 29.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.91 0.385 . . . . 1.1000000000000001 110.451 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.544 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.2 OUTLIER -73.84 -28.56 61.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.831 -0.622 . . . . 3.0899999999999999 111.835 -176.739 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.3 m -63.9 -38.53 91.41 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.757 0.313 . . . . 0.34999999999999998 110.823 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.2 t -63.55 -56.85 14.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.324 -0.398 . . . . 0.23000000000000001 110.273 178.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.544 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 15.7 ptp -58.58 -39.54 80.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.834 -0.621 . . . . 0.17000000000000001 111.21 -176.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.7 -41.0 98.9 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 120.675 -0.41 . . . . 0.34000000000000002 110.331 177.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -71.17 -39.29 71.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.271 -0.422 . . . . 1.3600000000000001 111.71 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.638 HG22 HD11 ' A' ' 104' ' ' LEU . 34.2 mm -64.99 -56.2 16.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 108.858 -0.793 . . . . 0.12 108.858 175.603 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.804 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.8 ttpt -51.57 -45.62 63.16 Favored 'General case' 0 C--O 1.223 -0.293 0 O-C-N 123.911 0.757 . . . . 0.79000000000000004 110.232 177.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.486 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 41.3 ttp -51.87 -54.18 32.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.28 -0.873 . . . . 0.28000000000000003 111.099 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.726 ' O ' HG13 ' A' ' 107' ' ' ILE . 24.4 m -62.33 -52.16 64.76 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.179 -0.464 . . . . 0.17999999999999999 110.395 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.938 HD13 HD21 ' A' ' 62' ' ' LEU . 27.0 mt -46.97 -54.5 10.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.737 -0.665 . . . . 0.089999999999999997 110.522 175.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.584 ' CG ' HD13 ' A' ' 48' ' ' LEU . 43.8 mt-30 -52.59 -46.39 66.92 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.826 -1.079 . . . . 1.2 112.239 176.595 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 102' ' ' MET . 13.7 mm100 -64.14 -27.93 69.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.671 0.748 . . . . 2.3700000000000001 110.287 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.726 HG13 ' O ' ' A' ' 103' ' ' THR . 7.2 mt -81.08 -41.05 18.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 114.737 -1.119 . . . . 0.14999999999999999 110.798 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.657 HD12 HD11 ' A' ' 48' ' ' LEU . 6.3 mt -67.29 -38.63 81.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.354 -0.385 . . . . 0.19 111.84 -178.084 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.2 p -59.97 -24.92 64.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.014 0.435 . . . . 1.1399999999999999 111.202 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 -62.25 -52.31 64.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.608 0.718 . . . . 1.6399999999999999 109.55 172.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.537 ' CG ' ' HA ' ' A' ' 43' ' ' SER . 21.5 m-85 -85.7 18.37 2.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.02 -0.991 . . . . 0.65000000000000002 110.472 177.705 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? . . . . . 0 C--N 1.318 -0.766 0 N-CA-C 107.842 -1.17 . . . . 0.76000000000000001 107.842 171.831 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.574 ' CD2' HG21 ' A' ' 103' ' ' THR . 56.2 m80 . . . . . 0 CA--C 1.511 -0.528 0 N-CA-C 109.624 -0.51 . . . . 0.75 109.624 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.9 p -157.71 168.54 26.93 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.604 -0.839 . . . . 1.0900000000000001 112.785 -176.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.448 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 173.54 -163.43 34.74 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 110.116 -1.194 . . . . 0.16 110.116 -178.339 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -100.29 135.66 41.38 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 117.513 0.657 . . . . 0.16 110.167 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -145.43 152.27 39.56 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.42 -0.355 . . . . 0.11 110.859 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.41 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 79.0 mt -111.7 122.21 65.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.446 -0.343 . . . . 0.33000000000000002 110.465 178.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.505 ' O ' HG13 ' A' ' 12' ' ' VAL . 32.4 t80 -126.17 132.6 51.78 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.218 -0.66 . . . . 0.35999999999999999 109.218 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 58.98 28.16 17.3 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.037 0.535 . . . . 0.80000000000000004 110.328 -176.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt 69.34 0.77 3.01 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.015 0.746 . . . . 2.1099999999999999 113.015 178.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -91.45 121.69 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 108.047 -1.094 . . . . 0.22 108.047 167.077 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.7 m -75.61 145.22 41.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.095 -0.502 . . . . 1.0700000000000001 110.21 -177.005 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.46 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.33 -156.81 8.46 Favored Glycine 0 N--CA 1.436 -1.363 0 C-N-CA 120.078 -1.058 . . . . 0.11 113.482 -177.267 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 15.8 mm -125.44 132.31 71.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 C-N-CA 123.217 0.607 . . . . 0.13 109.429 -177.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.572 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.73 135.96 38.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.704 -0.48 . . . . 0.13 109.704 -177.483 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.87 130.87 32.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.808 0.337 . . . . 0.10000000000000001 111.264 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.513 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 52.8 mt -86.16 138.12 19.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 109.685 -0.487 . . . . 0.27000000000000002 109.685 177.128 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -111.22 103.16 11.55 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.137 -0.483 . . . . 1.24 111.091 -174.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 31.1 mt-10 -115.94 170.36 8.54 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.163 -0.68 . . . . 1.2 109.163 175.555 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 26.5 t70 77.26 -3.28 2.49 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.37 1.081 . . . . 0.57999999999999996 109.583 -178.317 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 23' ' ' SER . 32.8 m -103.0 -173.92 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.046 0 CA-C-N 113.885 -1.507 . . . . 0.25 109.798 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.625 ' O ' HG23 ' A' ' 22' ' ' VAL . 53.6 m -73.01 166.52 42.72 Favored Pre-proline 0 C--N 1.315 -0.896 0 N-CA-C 105.211 -2.144 . . . . 1.1299999999999999 105.211 173.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -41.34 128.52 3.26 Favored 'Trans proline' 0 C--N 1.355 0.902 0 CA-C-N 121.037 1.406 . . . . 0.16 112.738 -141.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.498 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -50.21 142.18 10.26 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 114.105 -1.407 . . . . 0.10000000000000001 112.593 -165.317 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -127.74 169.4 13.89 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 114.447 -1.251 . . . . 0.32000000000000001 111.985 -168.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -120.46 107.25 12.66 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 107.939 -1.134 . . . . 0.089999999999999997 107.939 174.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.8 m -101.42 108.53 20.16 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 116.427 -0.351 . . . . 0.17000000000000001 111.193 -175.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.494 ' HH2' ' HG ' ' A' ' 31' ' ' SER . 87.8 t90 -85.3 131.13 34.46 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.853 -0.795 . . . . 0.14000000000000001 108.853 170.058 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.545 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 89.1 mtt180 -122.26 151.12 41.41 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.628 -0.878 . . . . 1.9099999999999999 108.628 172.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.672 ' OG ' ' HB3' ' A' ' 36' ' ' LYS . 2.8 m -61.99 172.49 1.36 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.16 -0.311 . . . . 0.59999999999999998 110.16 173.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.46 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.1 p -60.02 -36.13 76.58 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.218 -0.593 . . . . 0.26000000000000001 110.62 178.554 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -86.17 -14.68 43.33 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.397 -0.594 . . . . 2.1200000000000001 109.397 175.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.545 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 76.99 19.51 77.35 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.147 -0.933 . . . . 0.23000000000000001 112.513 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -84.37 -35.43 23.19 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.533 -0.914 . . . . 1.73 108.533 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.672 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 43.7 tttp -90.68 141.09 29.15 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.18 -1.373 . . . . 1.3 108.59 172.269 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.491 HG23 ' HG2' ' A' ' 30' ' ' ARG . 9.5 p -150.28 138.56 14.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 C-N-CA 120.834 -0.346 . . . . 0.17000000000000001 111.066 -176.519 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -145.07 125.02 13.48 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.973 -0.38 . . . . 0.40999999999999998 109.973 175.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 31.7 m -110.67 137.11 48.76 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.104 0.409 . . . . 0.14999999999999999 112.104 -174.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.37 129.53 56.58 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 N-CA-C 108.117 -1.068 . . . . 0.12 108.117 168.636 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.9 t -93.15 121.66 44.02 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 O-C-N 121.23 -0.919 . . . . 0.11 108.926 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.592 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -68.71 -18.56 64.27 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.104 0.779 . . . . 0.080000000000000002 113.104 -169.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.7 p -72.0 -11.93 61.0 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.066 -0.654 . . . . 0.87 109.75 175.231 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.2 p -111.31 13.07 21.66 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.345 -0.843 . . . . 0.14999999999999999 109.624 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.553 HG21 HD13 ' A' ' 62' ' ' LEU . 26.8 mm -113.75 138.04 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-N 115.712 -0.676 . . . . 0.12 109.25 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -101.75 -42.56 6.13 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.094 -0.503 . . . . 0.52000000000000002 110.456 -177.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.4 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 15.0 mtmm -142.17 172.7 12.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.306 -0.407 . . . . 1.4099999999999999 111.012 -176.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.844 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -151.01 149.04 29.09 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.591 -0.892 . . . . 0.72999999999999998 108.591 179.739 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.463 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 16.5 mm-40 -138.64 127.76 24.09 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 110.453 -0.203 . . . . 1.9399999999999999 110.453 -175.267 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.587 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -122.01 134.85 54.8 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.452 -0.78 . . . . 0.22 110.968 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.458 ' HB ' ' OG ' ' A' ' 55' ' ' SER . 69.1 p -63.37 115.39 17.71 Favored Pre-proline 0 C--O 1.234 0.247 0 CA-C-N 115.913 -0.585 . . . . 0.26000000000000001 110.409 -175.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 2.2 Cg_endo -54.98 158.95 10.31 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.953 2.436 . . . . 0.38 112.046 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.94 -11.76 49.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.273 -0.421 . . . . 0.66000000000000003 111.382 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.0 t -109.4 25.9 11.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.24 0.543 . . . . 1.5 110.358 176.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.458 ' OG ' ' HB ' ' A' ' 51' ' ' THR . 83.9 p -99.98 158.83 15.54 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.746 -0.464 . . . . 0.84999999999999998 109.746 176.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -82.84 12.68 4.55 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 121.298 0.571 . . . . 1.77 110.516 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.523 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 42.9 mmtm -130.6 162.97 28.16 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.539 -0.755 . . . . 1.6299999999999999 111.271 -171.586 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.438 ' O ' ' HG3' ' A' ' 59' ' ' MET . 3.5 mtp -136.9 97.95 3.65 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.997 -1.001 . . . . 1.1100000000000001 108.826 167.441 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.523 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -156.81 155.13 31.01 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.556 -0.747 . . . . 0.22 111.41 -171.557 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.596 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -131.94 119.03 20.57 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.383 -0.969 . . . . 0.10000000000000001 108.383 176.269 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.612 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 6.9 mtp180 -102.82 146.04 28.87 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 121.423 0.63 . . . . 2.9900000000000002 111.325 -179.011 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.941 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -125.63 104.72 8.53 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 114.524 -1.216 . . . . 0.13 108.787 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.532 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.0 mp -85.66 102.3 11.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.724 0.297 . . . . 0.28999999999999998 110.315 -172.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.434 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -63.94 152.96 48.18 Favored Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 115.854 -0.612 . . . . 0.54000000000000004 112.455 178.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 76.8 mttt . . . . . 0 C--N 1.317 -0.804 0 CA-C-O 121.436 0.636 . . . . 0.55000000000000004 112.509 -175.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 34.4 m-20 . . . . . 0 C--O 1.216 -0.671 0 N-CA-C 108.359 -0.978 . . . . 3.23 108.359 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 82' ' ' PRO . 46.2 mt-10 -64.86 -1.18 1.82 Allowed 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 112.651 0.611 . . . . 2.3900000000000001 112.651 -171.409 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.3 p -72.75 -9.18 58.35 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.401 0.62 . . . . 2.96 109.94 168.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.603 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 11.6 ptmm? -80.03 41.79 0.53 Allowed 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.261 -0.882 . . . . 2.4900000000000002 111.051 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.418 ' HE2' ' OE1' ' A' ' 79' ' ' GLU . 18.9 mttp -43.41 117.39 1.11 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.562 -0.744 . . . . 3.3999999999999999 111.411 -175.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.566 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 25.7 ttt180 -101.47 158.87 15.75 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.15 -0.932 . . . . 3.7999999999999998 109.118 -175.356 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 94.1 mttt -131.54 146.67 52.33 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.361 -0.607 . . . . 4.29 109.361 171.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.466 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER -76.62 -174.33 2.92 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.194 -0.457 . . . . 4.4100000000000001 110.229 -178.902 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -56.65 -32.94 65.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 111.801 0.297 . . . . 5.3399999999999999 111.801 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.466 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 21.5 mt-10 -81.02 -46.52 14.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.833 0.349 . . . . 5.3799999999999999 110.823 -178.331 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.01 13.66 1.17 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.669 -0.776 . . . . 4.3700000000000001 112.494 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 37.8 m-80 -71.1 129.01 37.85 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.402 -0.592 . . . . 4.5099999999999998 109.402 177.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.418 ' OE1' ' HE2' ' A' ' 71' ' ' LYS . 35.4 tt0 -70.05 101.85 1.91 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.099 0.476 . . . . 4.2800000000000002 110.083 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.566 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 10.1 m -113.88 98.76 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 CA-C-O 121.818 0.818 . . . . 3.1000000000000001 109.017 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.448 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.5 OUTLIER -87.74 112.64 50.09 Favored Pre-proline 0 C--N 1.311 -1.104 0 CA-C-N 115.762 -0.653 . . . . 2.5 110.035 -177.846 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.481 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 31.7 Cg_exo . . . . . 0 CA--C 1.511 -0.628 0 C-N-CA 123.152 2.568 . . . . 1.8700000000000001 112.636 -176.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.596 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 75.2 m-70 . . . . . 0 C--O 1.215 -0.743 0 N-CA-C 107.022 -1.473 . . . . 0.71999999999999997 107.022 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.612 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 25.2 ttm -139.99 124.96 18.51 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 119.056 0.844 . . . . 0.27000000000000002 111.047 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.425 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.6 m-85 -113.95 128.72 56.52 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.166 -0.925 . . . . 0.27000000000000002 109.443 178.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.449 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.6 OUTLIER -80.99 151.59 28.38 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.92 -0.4 . . . . 1.26 109.92 176.771 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.402 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 24.3 m-85 -132.75 173.37 11.43 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.057 0.455 . . . . 0.32000000000000001 110.809 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -124.9 -6.29 7.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.5 -0.773 . . . . 2.3799999999999999 109.424 172.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.412 ' HB2' HG23 ' A' ' 96' ' ' VAL . 49.2 m-80 -136.55 120.4 17.45 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.953 -0.567 . . . . 1.1000000000000001 110.882 -175.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.486 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.0 mmm180 -64.0 -35.58 81.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.344 -0.844 . . . . 3.0899999999999999 111.872 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.2 m -63.17 -36.62 84.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.448 -0.342 . . . . 0.34999999999999998 110.883 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.591 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.5 t -67.1 -57.19 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 CA-C-N 116.47 -0.332 . . . . 0.23000000000000001 110.203 178.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.596 ' HA ' HD12 ' A' ' 60' ' ' LEU . 12.9 ptp -56.59 -37.84 71.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.17000000000000001 111.363 -175.208 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.55 -43.18 85.78 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.602 -0.439 . . . . 0.34000000000000002 110.765 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.415 ' HA ' ' HE2' ' A' ' 102' ' ' MET . 8.1 m-80 -69.5 -41.49 76.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.447 -0.342 . . . . 1.3600000000000001 111.471 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.638 HG22 HD11 ' A' ' 104' ' ' LEU . 30.1 mm -62.45 -57.41 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 108.685 -0.857 . . . . 0.12 108.685 176.785 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.823 ' HA ' HD12 ' A' ' 104' ' ' LEU . 23.4 ttpp -50.12 -49.56 51.4 Favored 'General case' 0 C--O 1.218 -0.583 0 O-C-N 123.902 0.751 . . . . 0.79000000000000004 110.164 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.699 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 37.4 ttp -48.76 -59.8 3.25 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 123.961 0.788 . . . . 0.28000000000000003 111.391 177.428 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.782 ' O ' HG13 ' A' ' 107' ' ' ILE . 36.0 m -57.76 -50.46 73.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.304 -0.407 . . . . 0.17999999999999999 110.335 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.941 HD13 HD21 ' A' ' 62' ' ' LEU . 35.3 mt -46.81 -55.77 7.38 Favored 'General case' 0 C--O 1.221 -0.404 0 O-C-N 123.744 0.652 . . . . 0.089999999999999997 110.278 174.052 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.827 ' HG2' HD13 ' A' ' 48' ' ' LEU . 51.2 mt-30 -54.52 -44.95 73.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.913 -1.04 . . . . 1.2 112.134 177.236 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.699 ' HG3' ' O ' ' A' ' 102' ' ' MET . 85.7 mt-30 -61.82 -31.51 71.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.847 0.832 . . . . 2.3700000000000001 108.956 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.782 HG13 ' O ' ' A' ' 103' ' ' THR . 8.6 mt -80.99 -43.75 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 114.584 -1.189 . . . . 0.14999999999999999 111.163 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.844 HD12 HD11 ' A' ' 48' ' ' LEU . 9.0 mt -63.95 -37.52 80.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.164 -0.471 . . . . 0.19 111.638 -177.456 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.6 t -55.4 -30.92 61.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.283 -0.417 . . . . 1.1399999999999999 110.782 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -62.47 -41.61 98.89 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.264 0.554 . . . . 1.6399999999999999 109.732 176.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -97.73 18.73 15.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.701 -0.682 . . . . 0.65000000000000002 109.963 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.68 0 N-CA-C 107.926 -1.138 . . . . 0.76000000000000001 107.926 176.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.402 ' CD2' HG21 ' A' ' 103' ' ' THR . 76.0 m80 . . . . . 0 N--CA 1.473 0.691 0 N-CA-C 112.664 0.616 . . . . 0.75 112.664 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.4 p -149.03 171.89 15.64 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.214 -0.594 . . . . 1.0900000000000001 112.592 -170.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.51 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 169.77 -160.31 33.32 Favored Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 115.041 -0.981 . . . . 0.16 110.744 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.36 132.01 52.9 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 117.423 0.612 . . . . 0.16 110.315 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.538 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -143.82 147.43 34.1 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.566 -0.288 . . . . 0.11 111.709 -176.445 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.793 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 64.6 mt -104.44 133.59 48.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.874 0.369 . . . . 0.33000000000000002 110.178 175.068 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -132.85 129.14 38.07 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 108.534 -0.913 . . . . 0.35999999999999999 108.534 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 56.75 34.27 24.35 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.559 0.344 . . . . 0.80000000000000004 110.977 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm 69.72 -3.98 1.54 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.27 0.841 . . . . 2.1099999999999999 113.27 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.2 p -92.2 118.03 36.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 108.664 -0.865 . . . . 0.22 108.664 170.179 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -75.06 145.79 42.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.02 -0.536 . . . . 1.0700000000000001 110.337 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -160.71 -160.99 11.07 Favored Glycine 0 N--CA 1.439 -1.161 0 C-N-CA 120.149 -1.024 . . . . 0.11 113.244 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -124.66 132.38 71.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 109.281 -0.637 . . . . 0.13 109.281 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.574 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.49 135.39 41.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 110.221 -0.288 . . . . 0.13 110.221 -175.327 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.6 130.42 27.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.625 -0.261 . . . . 0.10000000000000001 111.499 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.465 HD13 ' HB ' ' A' ' 103' ' ' THR . 43.3 mt -85.55 137.48 20.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.384 0.611 . . . . 0.27000000000000002 110.449 176.34 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -106.76 106.23 16.65 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.999 -1.0 . . . . 1.24 110.791 -176.014 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -118.86 169.05 10.2 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.502 -0.555 . . . . 1.2 109.502 175.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.7 t70 76.25 -0.73 3.05 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 122.381 1.086 . . . . 0.57999999999999996 109.601 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 23' ' ' SER . 33.9 m -103.55 -171.65 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 113.7 -1.591 . . . . 0.25 109.869 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.63 ' O ' HG23 ' A' ' 22' ' ' VAL . 54.9 p -71.94 168.34 23.61 Favored Pre-proline 0 C--N 1.318 -0.775 0 N-CA-C 105.259 -2.126 . . . . 1.1299999999999999 105.259 175.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -42.73 128.29 4.94 Favored 'Trans proline' 0 C--N 1.355 0.92 0 CA-C-N 121.524 1.58 . . . . 0.16 112.059 -145.264 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.465 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.85 142.86 18.05 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-N 114.093 -1.412 . . . . 0.10000000000000001 112.245 -162.039 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -127.47 168.48 14.84 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 114.534 -1.212 . . . . 0.32000000000000001 112.133 -168.195 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.807 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -118.16 106.77 13.18 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.649 -1.241 . . . . 0.089999999999999997 107.649 173.593 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.492 HG23 ' OG1' ' A' ' 39' ' ' THR . 6.9 m -102.96 107.2 17.92 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 120.998 0.428 . . . . 0.17000000000000001 111.23 -176.418 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -85.02 131.39 34.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.716 -0.846 . . . . 0.14000000000000001 108.716 171.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.47 ' HG2' HG23 ' A' ' 37' ' ' VAL . 60.8 mtt85 -126.43 158.83 34.98 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.918 -0.771 . . . . 1.9099999999999999 108.918 174.5 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.0 p -68.15 176.33 2.76 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.669 -0.493 . . . . 0.59999999999999998 109.669 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.5 p -58.78 -35.96 73.65 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 120.524 -0.471 . . . . 0.26000000000000001 111.538 -179.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -93.77 -28.74 15.74 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.301 -0.629 . . . . 2.1200000000000001 109.301 172.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.439 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 101.2 17.41 22.52 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.313 -0.858 . . . . 0.23000000000000001 113.198 174.141 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -66.12 -48.26 71.44 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.865 -0.42 . . . . 1.73 109.865 173.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.0 tttt -82.89 138.05 34.02 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.925 -0.768 . . . . 1.3 108.925 174.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.47 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.5 p -149.25 135.64 12.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.009 0.433 . . . . 0.17000000000000001 111.157 -177.761 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -144.58 128.92 17.86 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.881 -0.415 . . . . 0.40999999999999998 109.881 178.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.492 ' OG1' HG23 ' A' ' 28' ' ' THR . 47.0 m -117.86 137.96 52.43 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.343 0.497 . . . . 0.14999999999999999 112.343 -172.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.807 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.68 130.7 55.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 N-CA-C 108.329 -0.989 . . . . 0.12 108.329 169.242 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.41 ' O ' HG12 ' A' ' 45' ' ' ILE . 94.5 t -93.13 120.43 42.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 O-C-N 121.305 -0.872 . . . . 0.11 108.702 172.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.627 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -67.83 -18.86 64.97 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.875 0.695 . . . . 0.080000000000000002 112.875 -170.119 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.426 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 15.5 t -69.78 -13.57 62.35 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.327 -0.549 . . . . 0.87 109.84 174.47 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.2 p -108.99 6.81 25.5 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.934 -0.575 . . . . 0.14999999999999999 109.844 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.6 HG21 ' CD1' ' A' ' 62' ' ' LEU . 32.2 mm -109.27 138.37 36.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.671 -0.695 . . . . 0.12 109.792 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -102.58 -45.91 4.9 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.805 -0.634 . . . . 0.52000000000000002 110.631 -178.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.538 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 23.5 mtpp -133.21 173.77 11.09 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.368 0.604 . . . . 1.4099999999999999 111.861 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.823 HD11 HD12 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -153.38 142.09 20.98 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.809 -1.087 . . . . 0.72999999999999998 108.657 178.009 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.49 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 15.1 mm-40 -136.53 127.16 27.06 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 110.348 -0.241 . . . . 1.9399999999999999 110.348 -174.152 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.427 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -121.92 135.2 54.86 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 121.548 -0.72 . . . . 0.22 111.583 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.425 HG21 ' CB ' ' A' ' 57' ' ' LYS . 80.0 p -64.9 119.03 54.71 Favored Pre-proline 0 N--CA 1.467 0.403 0 CA-C-N 115.909 -0.587 . . . . 0.26000000000000001 110.949 -176.098 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.463 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 23.7 Cg_exo -55.56 159.36 11.15 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.859 2.372 . . . . 0.38 112.006 178.739 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.67 -14.89 63.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.91 -0.586 . . . . 0.66000000000000003 110.721 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.58 -7.68 43.38 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.474 -0.785 . . . . 1.5 110.386 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.48 ' C ' ' H ' ' A' ' 57' ' ' LYS . 42.4 m -83.88 147.35 27.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.938 -0.574 . . . . 0.84999999999999998 111.805 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -70.46 11.94 0.3 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.479 -0.782 . . . . 1.77 111.851 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.554 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 25.8 mmtp -127.03 157.96 38.21 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.58 -0.737 . . . . 1.6299999999999999 111.41 -171.826 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.539 ' O ' ' HG3' ' A' ' 59' ' ' MET . 70.8 mmm -130.94 96.36 4.04 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.017 -1.105 . . . . 1.1100000000000001 108.017 165.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.554 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -156.15 152.51 28.0 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.52 0.676 . . . . 0.22 111.891 -172.181 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.5 tt -131.67 119.62 21.63 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.665 -1.152 . . . . 0.10000000000000001 108.453 178.094 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.49 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 7.6 mtp180 -102.24 144.24 31.01 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 121.122 0.487 . . . . 2.9900000000000002 111.154 -178.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.937 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -122.88 111.81 17.1 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.167 -0.924 . . . . 0.13 109.228 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.538 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 2.8 mp -87.98 107.76 17.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 122.462 0.305 . . . . 0.28999999999999998 110.93 -171.332 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.96 143.75 35.37 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.216 -0.516 . . . . 0.54000000000000004 112.241 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.434 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.1 mttt . . . . . 0 C--N 1.321 -0.658 0 N-CA-C 113.221 0.823 . . . . 0.55000000000000004 113.221 -174.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.607 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 24.1 m-20 . . . . . 0 N--CA 1.447 -0.62 0 N-CA-C 108.103 -1.073 . . . . 3.23 108.103 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.25 -3.8 1.49 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.22 0.822 . . . . 2.3900000000000001 113.22 -169.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.1 p -71.46 -12.2 61.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.134 0.492 . . . . 2.96 109.959 171.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 21.1 ptmt -76.4 42.91 0.29 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.693 0.797 . . . . 2.4900000000000002 110.772 176.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -45.33 115.67 0.97 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.689 -0.687 . . . . 3.3999999999999999 110.827 -174.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.594 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 79.6 ttt180 -94.65 163.55 13.33 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.605 -0.725 . . . . 3.7999999999999998 109.39 -172.124 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 93.7 mttt -130.74 146.19 52.14 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.882 -0.414 . . . . 4.29 109.882 173.48 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -88.82 -165.66 1.39 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.477 -0.783 . . . . 4.4100000000000001 110.781 -173.734 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -66.13 -16.56 64.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.337 0.495 . . . . 5.3399999999999999 112.337 -176.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.427 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 22.6 mt-10 -107.02 -8.0 16.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.866 0.365 . . . . 5.3799999999999999 111.088 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.72 14.32 47.2 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.529 -0.844 . . . . 4.3700000000000001 112.21 -178.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 23.3 m120 -71.28 138.9 49.74 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.899 -0.778 . . . . 4.5099999999999998 108.899 176.699 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -76.0 100.55 4.93 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.123 0.487 . . . . 4.2800000000000002 109.811 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.594 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 11.0 m -114.24 106.27 20.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.292 0.567 . . . . 3.1000000000000001 109.797 -177.111 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.476 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 t -80.19 128.13 74.3 Favored Pre-proline 0 C--N 1.316 -0.871 0 C-N-CA 120.307 -0.557 . . . . 2.5 110.497 -175.092 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 25.4 Cg_exo . . . . . 0 CA--C 1.513 -0.563 0 C-N-CA 123.254 2.636 . . . . 1.8700000000000001 112.099 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 70.2 m80 . . . . . 0 C--O 1.223 -0.32 0 N-CA-C 107.964 -1.124 . . . . 0.71999999999999997 107.964 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.436 ' HG3' ' HG2' ' A' ' 61' ' ' ARG . 28.0 ttm -141.22 135.47 30.76 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 118.627 0.649 . . . . 0.27000000000000002 110.611 174.117 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.539 ' O ' ' HA ' ' A' ' 59' ' ' MET . 11.3 m-85 -126.34 134.74 51.0 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.044 -0.526 . . . . 0.27000000000000002 109.724 174.275 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.793 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -80.83 158.47 25.38 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.32 -0.622 . . . . 1.26 109.32 176.65 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.506 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.7 m-85 -140.16 171.25 14.43 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.896 0.379 . . . . 0.32000000000000001 110.99 -178.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -121.94 -15.04 7.93 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.12 -0.491 . . . . 2.3799999999999999 110.288 175.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.444 ' HB2' HG23 ' A' ' 96' ' ' VAL . 41.6 m-80 -135.86 122.16 20.48 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.238 0.542 . . . . 1.1000000000000001 110.68 -177.511 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.544 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.8 mmm180 -59.86 -34.8 73.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.098 -0.956 . . . . 3.0899999999999999 112.276 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.443 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 19.2 m -61.96 -32.67 73.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.854 0.359 . . . . 0.34999999999999998 110.567 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.635 ' O ' HG12 ' A' ' 100' ' ' ILE . 18.8 t -69.92 -58.8 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 CA-C-N 116.249 -0.432 . . . . 0.23000000000000001 110.363 179.047 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.575 ' HA ' HD12 ' A' ' 60' ' ' LEU . 11.6 ptp -55.84 -37.76 69.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.088 -0.505 . . . . 0.17000000000000001 111.261 -176.578 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.443 ' N ' ' HG3' ' A' ' 97' ' ' MET . 37.4 t70 -64.65 -48.23 75.57 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.628 -0.429 . . . . 0.34000000000000002 110.096 176.654 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 95' ' ' THR . 7.9 t-20 -63.42 -41.68 98.7 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.608 0.763 . . . . 1.3600000000000001 111.409 -179.274 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.656 HG22 HD11 ' A' ' 104' ' ' LEU . 30.9 mm -63.97 -58.51 7.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 109.278 -0.638 . . . . 0.12 109.278 178.082 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.851 ' HA ' HD12 ' A' ' 104' ' ' LEU . 23.5 ttpp -51.44 -47.86 62.92 Favored 'General case' 0 C--O 1.215 -0.729 0 O-C-N 123.785 0.678 . . . . 0.79000000000000004 110.02 177.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.501 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.9 ttp -48.65 -54.38 14.93 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.238 -0.892 . . . . 0.28000000000000003 111.255 176.822 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.734 ' O ' HG13 ' A' ' 107' ' ' ILE . 28.1 m -60.69 -55.2 36.11 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.835 -0.621 . . . . 0.17999999999999999 110.205 178.608 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.937 HD13 HD21 ' A' ' 62' ' ' LEU . 30.7 mt -45.8 -55.03 7.09 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.391 -0.822 . . . . 0.089999999999999997 110.613 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.761 ' HG2' HD13 ' A' ' 48' ' ' LEU . 49.8 mt-30 -53.36 -45.02 69.01 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.519 -1.219 . . . . 1.2 112.454 178.158 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.501 ' HG2' ' O ' ' A' ' 102' ' ' MET . 75.5 mm-40 -64.87 -34.96 79.63 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.674 0.75 . . . . 2.3700000000000001 109.85 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.734 HG13 ' O ' ' A' ' 103' ' ' THR . 8.9 mt -71.45 -45.49 68.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.604 -1.18 . . . . 0.14999999999999999 110.879 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.823 HD12 HD11 ' A' ' 48' ' ' LEU . 10.1 mt -63.09 -40.48 89.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.135 -0.484 . . . . 0.19 111.331 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 t -58.18 -26.5 62.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.196 -0.456 . . . . 1.1399999999999999 111.068 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -63.41 -49.11 75.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.062 0.458 . . . . 1.6399999999999999 109.883 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.426 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 34.2 m-85 -79.75 -12.16 59.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.619 -0.718 . . . . 0.65000000000000002 110.013 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.321 -0.632 0 CA-C-N 115.102 -0.954 . . . . 0.76000000000000001 108.819 174.787 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.491 ' HB3' ' HB ' ' A' ' 18' ' ' ILE . 75.6 m80 . . . . . 0 CA--C 1.515 -0.393 0 N-CA-C 110.448 -0.205 . . . . 0.75 110.448 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.8 t -152.17 155.02 36.99 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.891 -0.724 . . . . 1.0900000000000001 112.626 -168.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.565 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . -174.44 -164.31 29.15 Favored Glycine 0 N--CA 1.437 -1.245 0 CA-C-N 114.341 -1.3 . . . . 0.16 110.554 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.98 135.05 39.54 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 117.558 0.679 . . . . 0.16 110.906 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -148.76 153.26 37.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.389 -0.369 . . . . 0.11 111.647 -178.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.766 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.9 mt -112.25 128.29 68.96 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 CA-C-O 120.686 0.279 . . . . 0.33000000000000002 110.461 177.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -126.97 133.53 50.56 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 108.897 -0.779 . . . . 0.35999999999999999 108.897 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 58.85 27.77 16.58 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.758 0.423 . . . . 0.80000000000000004 110.857 -178.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt 70.5 0.06 3.1 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.218 0.607 . . . . 2.1099999999999999 112.555 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.3 p -92.7 122.46 44.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 108.545 -0.909 . . . . 0.22 108.545 167.106 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.9 p -81.71 145.98 30.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.224 -0.444 . . . . 1.0700000000000001 111.072 -173.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.451 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -162.68 -154.92 7.8 Favored Glycine 0 N--CA 1.439 -1.103 0 C-N-CA 120.375 -0.917 . . . . 0.11 113.461 -177.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.9 mm -126.71 130.5 71.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 109.334 -0.617 . . . . 0.13 109.334 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.575 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -100.8 137.07 29.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 110.101 -0.333 . . . . 0.13 110.101 -175.857 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.83 129.8 28.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.701 0.286 . . . . 0.10000000000000001 111.573 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.491 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 41.3 mt -85.5 139.02 18.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.237 0.542 . . . . 0.27000000000000002 109.81 174.882 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.438 ' O ' ' HA ' ' A' ' 25' ' ' ALA . 17.4 t30 -110.33 103.26 11.9 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.973 -1.012 . . . . 1.24 111.301 -174.354 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 31.1 mt-10 -114.61 169.76 8.82 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.863 -0.791 . . . . 1.2 108.863 174.175 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.457 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 38.0 t70 79.49 -5.59 1.91 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 122.446 1.117 . . . . 0.57999999999999996 109.776 -176.511 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 23' ' ' SER . 22.8 m -103.23 -172.73 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.05 0 CA-C-N 113.767 -1.561 . . . . 0.25 109.406 178.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.644 ' O ' HG23 ' A' ' 22' ' ' VAL . 59.3 p -72.41 167.92 28.31 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 105.199 -2.149 . . . . 1.1299999999999999 105.199 175.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -41.66 127.04 3.35 Favored 'Trans proline' 0 C--N 1.355 0.892 0 CA-C-N 121.317 1.506 . . . . 0.16 112.729 -143.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.438 ' HA ' ' O ' ' A' ' 19' ' ' ASN . . . -43.38 136.8 2.98 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 113.841 -1.527 . . . . 0.10000000000000001 112.895 -168.705 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.68 169.07 12.33 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 114.092 -1.413 . . . . 0.32000000000000001 111.679 -169.683 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.668 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -119.57 105.38 11.16 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 107.807 -1.183 . . . . 0.089999999999999997 107.807 174.699 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.7 m -104.58 106.89 17.56 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-O 121.155 0.502 . . . . 0.17000000000000001 111.245 -176.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.41 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 79.9 t90 -84.63 128.61 34.69 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.965 -0.754 . . . . 0.14000000000000001 108.965 172.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.474 ' HG2' HG23 ' A' ' 37' ' ' VAL . 96.1 mtt180 -120.48 158.11 27.94 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.455 -0.943 . . . . 1.9099999999999999 108.455 172.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 p -70.18 176.09 4.12 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.275 -0.639 . . . . 0.59999999999999998 109.275 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.451 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 4.2 p -57.32 -36.25 70.88 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.524 . . . . 0.26000000000000001 111.004 -179.022 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -91.82 -30.92 15.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.569 0.699 . . . . 2.1200000000000001 109.759 172.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.421 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 99.5 15.5 32.0 Favored Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.152 -0.931 . . . . 0.23000000000000001 112.769 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.92 -42.06 95.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.334 -0.617 . . . . 1.73 109.334 175.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -91.27 139.41 30.76 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.815 -0.809 . . . . 1.3 108.815 173.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.474 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.9 p -149.61 137.72 14.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 120.79 0.328 . . . . 0.17000000000000001 110.967 -179.071 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -144.51 129.04 18.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.634 -0.257 . . . . 0.40999999999999998 110.351 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 53.3 m -112.52 143.59 43.42 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.216 0.451 . . . . 0.14999999999999999 112.216 -174.461 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.668 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -113.6 129.89 68.62 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.722 0 N-CA-C 107.923 -1.14 . . . . 0.12 107.923 167.847 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 67.2 t -92.32 121.04 42.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 O-C-N 121.024 -1.047 . . . . 0.11 108.914 173.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.619 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -68.91 -18.38 64.1 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 113.011 0.745 . . . . 0.080000000000000002 113.011 -169.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 p -69.02 -16.76 63.79 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.574 0.702 . . . . 0.87 109.382 175.184 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.415 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 4.7 p -109.06 16.62 22.43 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.977 -1.011 . . . . 0.14999999999999999 110.088 -178.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.489 HG21 HD13 ' A' ' 62' ' ' LEU . 31.2 mm -112.25 138.38 41.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.759 -0.46 . . . . 0.12 109.759 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -102.07 -40.22 6.94 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.013 -0.54 . . . . 0.52000000000000002 110.657 -176.62 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.459 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 12.4 mtmm -144.96 174.46 11.0 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.872 0.367 . . . . 1.4099999999999999 111.26 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.627 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -151.34 133.63 15.32 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.632 -0.877 . . . . 0.72999999999999998 108.632 177.079 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.718 ' HG3' HD11 ' A' ' 63' ' ' ILE . 9.2 mt-30 -130.01 127.2 39.5 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 110.285 -0.265 . . . . 1.9399999999999999 110.285 -176.459 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -118.06 141.47 48.44 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 121.914 -0.492 . . . . 0.22 111.039 178.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.444 HG21 ' HB3' ' A' ' 57' ' ' LYS . 53.0 p -62.29 121.24 65.24 Favored Pre-proline 0 C--N 1.332 -0.175 0 CA-C-N 115.912 -0.585 . . . . 0.26000000000000001 110.633 -178.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 55' ' ' SER . 24.0 Cg_exo -53.96 163.58 3.04 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.66 2.24 . . . . 0.38 112.465 178.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.73 79.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.146 -0.479 . . . . 0.66000000000000003 110.598 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.0 m -76.11 -13.73 60.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.569 -0.741 . . . . 1.5 111.035 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 52' ' ' PRO . 46.1 m -75.1 135.3 41.18 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 121.697 0.761 . . . . 0.84999999999999998 111.391 179.39 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -59.46 -26.77 65.51 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.009 -1.45 . . . . 1.77 110.756 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.444 ' HB3' HG21 ' A' ' 51' ' ' THR . 37.0 mmtt -82.74 146.74 28.84 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 114.399 -1.273 . . . . 1.6299999999999999 111.493 -177.452 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.569 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.4 OUTLIER -123.07 96.63 5.09 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.032 -0.986 . . . . 1.1100000000000001 108.564 170.021 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.569 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -156.31 152.31 27.5 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 121.585 0.707 . . . . 0.22 112.069 -173.543 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -129.83 118.89 22.47 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.553 -1.203 . . . . 0.10000000000000001 108.143 177.278 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.415 ' HG2' ' HG3' ' A' ' 88' ' ' MET . 15.0 mtm180 -101.83 133.47 46.54 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.229 0.538 . . . . 2.9900000000000002 110.886 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.944 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -111.84 107.26 16.24 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 115.099 -0.955 . . . . 0.13 109.205 176.518 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.718 HD11 ' HG3' ' A' ' 49' ' ' GLN . 1.4 mp -85.31 97.81 5.88 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 109.368 -0.604 . . . . 0.28999999999999998 109.368 -172.443 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.463 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -76.31 134.48 15.72 Favored Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 115.941 -0.572 . . . . 0.54000000000000004 112.46 -176.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.437 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 96.1 mttt . . . . . 0 C--N 1.321 -0.672 0 C-N-CA 123.162 0.585 . . . . 0.55000000000000004 112.188 -176.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.75 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 18.7 t70 . . . . . 0 C--O 1.218 -0.583 0 N-CA-C 109.02 -0.733 . . . . 3.23 109.02 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.11 -2.3 5.41 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.013 0.745 . . . . 2.3900000000000001 113.013 -169.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.16 -14.16 62.18 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.155 0.503 . . . . 2.96 110.059 170.105 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.75 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.1 ptpt -82.3 36.22 0.46 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.759 -0.655 . . . . 2.4900000000000002 110.742 175.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.508 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 31.5 mmtm -44.97 116.1 1.02 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.624 -0.51 . . . . 3.3999999999999999 109.624 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.618 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 60.4 ttt180 -96.87 164.49 12.53 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 108.755 -0.831 . . . . 3.7999999999999998 108.755 -173.065 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 57.3 mttp -127.69 141.88 51.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.987 0.422 . . . . 4.29 110.023 171.449 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -82.69 -171.07 3.3 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.466 -0.788 . . . . 4.4100000000000001 110.451 -176.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -61.27 -31.14 70.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 111.606 0.225 . . . . 5.3399999999999999 111.606 -178.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.478 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 28.1 mt-10 -85.14 -18.81 33.04 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.079 -0.248 . . . . 5.3799999999999999 111.332 -179.11 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 99.84 25.67 8.97 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.403 -0.903 . . . . 4.3700000000000001 112.952 177.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.537 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 31.1 m-80 -90.47 144.69 25.56 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.233 -0.654 . . . . 4.5099999999999998 109.233 176.256 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -69.86 91.45 0.65 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.883 0.373 . . . . 4.2800000000000002 110.168 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.618 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.7 m -102.68 97.38 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 CA-C-O 122.014 0.911 . . . . 3.1000000000000001 108.99 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.508 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 2.2 p -83.04 130.82 55.85 Favored Pre-proline 0 C--N 1.31 -1.15 0 CA-C-N 115.313 -0.858 . . . . 2.5 109.784 -178.221 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 47.8 Cg_exo . . . . . 0 CA--C 1.512 -0.599 0 C-N-CA 122.77 2.313 . . . . 1.8700000000000001 111.993 -176.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 59.3 m-70 . . . . . 0 C--O 1.217 -0.619 0 N-CA-C 109.361 -0.607 . . . . 0.71999999999999997 109.361 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.415 ' HG3' ' HG2' ' A' ' 61' ' ' ARG . 33.5 ttm -107.75 131.95 53.9 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.857 -0.737 . . . . 0.27000000000000002 111.643 -176.671 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.7 m-85 -121.19 133.06 55.17 Favored 'General case' 0 C--O 1.215 -0.714 0 CA-C-N 115.5 -0.773 . . . . 0.27000000000000002 109.869 177.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.766 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -80.05 159.23 26.24 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.231 -0.655 . . . . 1.26 109.231 176.501 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.566 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 18.7 m-85 -136.85 173.28 11.87 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.377 0.608 . . . . 0.32000000000000001 112.021 -177.392 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -118.7 -21.46 7.87 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.043 -0.98 . . . . 2.3799999999999999 110.208 178.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.482 ' HB2' HG23 ' A' ' 96' ' ' VAL . 53.4 m-80 -139.49 125.95 20.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.215 0.531 . . . . 1.1000000000000001 110.74 -177.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.588 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.7 mmm180 -57.89 -30.88 66.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.192 -0.913 . . . . 3.0899999999999999 111.997 177.959 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.7 m -64.27 -29.22 70.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.004 0.43 . . . . 0.34999999999999998 110.554 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.732 ' HA ' ' ND2' ' A' ' 99' ' ' ASN . 5.2 t -85.15 -46.68 17.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 116.233 -0.44 . . . . 0.23000000000000001 110.983 -177.347 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.62 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.2 ptp -61.72 -25.56 67.5 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.171 -0.612 . . . . 0.17000000000000001 109.668 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 102' ' ' MET . 20.8 t70 -77.39 -38.59 49.57 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.137 -0.483 . . . . 0.34000000000000002 110.642 172.556 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ASN . . . . . 0.732 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 11.2 p30 -77.12 -33.58 56.79 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.705 0.261 . . . . 1.3600000000000001 111.705 -175.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.651 HG22 HD11 ' A' ' 104' ' ' LEU . 39.2 mm -70.52 -56.02 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.529 0 N-CA-C 108.388 -0.967 . . . . 0.12 108.388 174.305 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.782 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.5 ttpt -48.89 -48.51 42.27 Favored 'General case' 0 C--O 1.218 -0.569 0 O-C-N 123.976 0.797 . . . . 0.79000000000000004 109.752 176.648 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.764 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 40.7 ttp -48.44 -59.62 3.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.49 -0.777 . . . . 0.28000000000000003 110.757 177.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.724 ' O ' HG13 ' A' ' 107' ' ' ILE . 60.0 m -57.77 -52.89 63.59 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.483 0.489 . . . . 0.17999999999999999 110.71 -179.514 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.944 HD13 HD21 ' A' ' 62' ' ' LEU . 24.7 mt -47.28 -55.42 8.74 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.486 0.66 . . . . 0.089999999999999997 110.527 175.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.547 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.3 mt-30 -51.69 -44.21 63.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.615 -1.175 . . . . 1.2 112.074 177.003 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.764 ' HG3' ' O ' ' A' ' 102' ' ' MET . 81.0 mt-30 -64.36 -35.47 80.97 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.725 0.774 . . . . 2.3700000000000001 109.367 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.724 HG13 ' O ' ' A' ' 103' ' ' THR . 7.6 mt -75.95 -43.35 39.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 114.257 -1.338 . . . . 0.14999999999999999 111.559 -176.25 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.585 HD12 HD11 ' A' ' 48' ' ' LEU . 7.2 mt -62.19 -43.15 97.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.25 0.463 . . . . 0.19 112.25 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.455 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 24.2 t -62.45 -20.17 64.26 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.69 0.281 . . . . 1.1399999999999999 111.279 -176.23 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -65.21 -44.21 89.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.518 0.675 . . . . 1.6399999999999999 109.307 173.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -87.54 -11.78 47.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.088 -0.96 . . . . 0.65000000000000002 110.303 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.455 ' CB ' ' HA ' ' A' ' 109' ' ' SER . 1.8 tpmt? . . . . . 0 C--N 1.324 -0.511 0 N-CA-C 108.795 -0.817 . . . . 0.76000000000000001 108.795 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.445 ' HB3' ' HB ' ' A' ' 18' ' ' ILE . 75.9 m80 . . . . . 0 N--CA 1.472 0.665 0 N-CA-C 112.498 0.555 . . . . 0.75 112.498 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.2 t -153.03 157.74 40.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.779 0.8 . . . . 1.0900000000000001 112.717 -169.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.485 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -176.08 -170.04 38.33 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 114.125 -1.398 . . . . 0.16 109.83 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -93.19 135.17 34.64 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 117.71 0.755 . . . . 0.16 110.375 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.44 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -145.85 146.04 30.98 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.275 -0.42 . . . . 0.11 111.367 -177.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.455 HG12 ' HA ' ' A' ' 13' ' ' SER . 85.1 mt -107.37 120.65 59.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.304 -0.407 . . . . 0.33000000000000002 110.287 177.62 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -123.36 137.47 54.82 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.801 -0.814 . . . . 0.35999999999999999 108.801 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 57.27 25.66 11.39 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.659 0.384 . . . . 0.80000000000000004 110.736 -176.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt 69.14 5.63 5.2 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.774 0.657 . . . . 2.1099999999999999 112.774 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -97.48 129.9 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 108.884 -0.784 . . . . 0.22 108.884 166.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.455 ' HA ' HG12 ' A' ' 8' ' ' ILE . 15.0 m -78.53 146.07 34.52 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.02 0.438 . . . . 1.0700000000000001 110.861 -175.234 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.406 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -164.19 -160.18 11.69 Favored Glycine 0 N--CA 1.437 -1.273 0 C-N-CA 120.133 -1.032 . . . . 0.11 113.052 -178.409 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.6 mm -126.05 133.11 69.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.148 -0.686 . . . . 0.13 109.148 -178.671 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.524 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.75 134.91 42.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 109.886 -0.413 . . . . 0.13 109.886 -176.862 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.95 130.61 31.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.568 0.223 . . . . 0.10000000000000001 111.149 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.445 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 47.3 mt -86.6 139.4 17.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.311 0.577 . . . . 0.27000000000000002 110.397 175.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -110.38 105.88 15.04 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 114.933 -1.03 . . . . 1.24 111.185 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -116.9 170.41 8.64 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.146 -0.687 . . . . 1.2 109.146 174.692 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t70 77.78 -1.49 2.62 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 122.505 1.145 . . . . 0.57999999999999996 109.399 -179.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' ' 23' ' ' SER . 31.6 m -103.48 -171.86 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 113.559 -1.655 . . . . 0.25 109.383 177.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.636 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.7 p -72.67 168.65 22.2 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 105.202 -2.148 . . . . 1.1299999999999999 105.202 174.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.4 ' O ' HG13 ' A' ' 41' ' ' VAL . 72.9 Cg_exo -41.53 129.0 3.59 Favored 'Trans proline' 0 C--N 1.357 0.994 0 CA-C-N 121.501 1.572 . . . . 0.16 112.368 -145.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.469 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.56 142.17 18.64 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 114.164 -1.38 . . . . 0.10000000000000001 112.381 -162.086 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.76 168.68 12.87 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.64 -1.163 . . . . 0.32000000000000001 112.019 -170.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.754 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -119.79 108.97 15.04 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.798 -1.186 . . . . 0.089999999999999997 107.798 175.285 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m -103.98 107.08 17.81 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 120.761 0.315 . . . . 0.17000000000000001 111.1 -176.197 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.423 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 86.9 t90 -86.85 129.04 35.04 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.122 -0.696 . . . . 0.14000000000000001 109.122 171.365 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.498 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 92.0 mtt180 -123.32 160.55 26.48 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.059 -0.719 . . . . 1.9099999999999999 109.059 172.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.4 p -70.65 175.72 4.7 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.204 -0.665 . . . . 0.59999999999999998 109.204 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.406 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.0 p -59.32 -35.88 74.62 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.221 -0.592 . . . . 0.26000000000000001 111.104 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -88.39 -32.56 18.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.579 0.704 . . . . 2.1200000000000001 109.396 171.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.498 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 98.56 14.79 36.69 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 114.957 -1.019 . . . . 0.23000000000000001 113.339 173.597 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -67.47 -40.96 85.31 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.186 0.517 . . . . 1.73 109.776 174.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.2 135.58 33.52 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.577 -0.897 . . . . 1.3 108.577 174.349 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 12.0 p -149.46 140.26 16.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 C-N-CA 120.846 -0.342 . . . . 0.17000000000000001 111.461 -177.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -144.32 125.4 14.51 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.832 -0.432 . . . . 0.40999999999999998 109.832 175.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 41.1 m -109.26 137.63 46.84 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.752 0.279 . . . . 0.14999999999999999 111.752 -175.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.754 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -107.98 128.84 63.02 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 108.329 -0.989 . . . . 0.12 108.329 169.583 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.409 ' O ' HG12 ' A' ' 45' ' ' ILE . 79.5 t -92.84 120.02 41.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 O-C-N 121.234 -0.916 . . . . 0.11 108.781 173.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.524 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.08 -19.59 64.07 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.077 0.769 . . . . 0.080000000000000002 113.077 -169.194 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.6 p -69.46 -14.87 63.12 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 119.821 -0.752 . . . . 0.87 109.553 175.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.6 p -109.93 11.34 24.16 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.477 -0.783 . . . . 0.14999999999999999 109.921 -179.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.597 HG21 ' CD1' ' A' ' 62' ' ' LEU . 20.5 mm -111.84 139.88 34.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.718 -0.674 . . . . 0.12 109.263 178.028 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -108.44 -40.73 5.04 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.396 -0.365 . . . . 0.52000000000000002 110.914 -176.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.535 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 34.6 mtpt -132.61 167.83 19.34 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.709 0.766 . . . . 1.4099999999999999 111.402 -178.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.594 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -150.77 132.69 15.12 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.432 -1.258 . . . . 0.72999999999999998 107.862 174.811 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.409 ' HB2' ' HE ' ' A' ' 61' ' ' ARG . 9.0 mm-40 -133.06 114.76 14.3 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.329 -0.249 . . . . 1.9399999999999999 110.329 -172.413 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.448 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -110.09 145.16 37.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.827 0.346 . . . . 0.22 110.981 -178.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 57' ' ' LYS . 76.4 p -67.54 118.42 56.91 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.765 -0.652 . . . . 0.26000000000000001 110.781 -177.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.542 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 9.6 Cg_exo -59.82 163.16 14.12 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.445 2.097 . . . . 0.38 111.737 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.96 -8.05 53.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.199 -0.455 . . . . 0.66000000000000003 111.032 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.4 t -94.22 -4.82 48.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.358 0.599 . . . . 1.5 109.676 174.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.542 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 33.9 m -87.65 143.23 27.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.601 -0.727 . . . . 0.84999999999999998 111.175 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -69.24 -12.07 61.35 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.031 -0.986 . . . . 1.77 110.615 175.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.416 ' HB3' HG21 ' A' ' 51' ' ' THR . 1.4 mptp? -99.86 154.06 18.65 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 114.894 -1.048 . . . . 1.6299999999999999 111.391 -174.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.415 ' HE3' ' HB3' ' A' ' 58' ' ' MET . 80.5 mmm -127.67 98.25 5.13 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.109 -0.7 . . . . 1.1100000000000001 109.109 168.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.467 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.2 OUTLIER -156.36 155.59 32.45 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.869 -0.605 . . . . 0.22 111.644 -173.205 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.577 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.5 tt -130.81 119.15 21.84 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.363 -0.977 . . . . 0.10000000000000001 108.363 175.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.495 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 52.2 mtm180 -101.24 146.32 27.69 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.877 0.37 . . . . 2.9900000000000002 111.288 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.899 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -128.15 106.75 9.27 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.399 -0.819 . . . . 0.13 109.565 179.563 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.559 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.6 mp -95.71 113.97 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 122.509 0.323 . . . . 0.28999999999999998 110.478 -172.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.49 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -65.25 169.22 28.57 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 121.26 -0.495 . . . . 0.54000000000000004 113.194 178.909 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 77.3 mttt . . . . . 0 C--N 1.319 -0.739 0 CA-C-O 120.871 0.367 . . . . 0.55000000000000004 110.926 177.807 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.763 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.1 t70 . . . . . 0 C--O 1.217 -0.622 0 N-CA-C 108.119 -1.067 . . . . 3.23 108.119 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -73.16 -2.24 20.79 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.847 0.314 . . . . 2.3900000000000001 111.847 -170.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.8 p -71.53 -6.3 39.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.36 0.6 . . . . 2.96 110.166 171.102 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.763 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 17.8 ptmt -91.35 36.17 0.93 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.677 -0.692 . . . . 2.4900000000000002 110.402 175.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.578 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 13.1 mmmt -44.33 113.93 0.61 Allowed 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.132 -0.692 . . . . 3.3999999999999999 109.132 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.602 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.0 ttt180 -102.4 167.02 10.22 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.621 -0.718 . . . . 3.7999999999999998 109.303 -168.246 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.501 ' N ' ' HG2' ' A' ' 72' ' ' ARG . 56.5 mttp -132.6 128.46 37.2 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.642 -0.503 . . . . 4.29 109.642 171.174 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -83.3 -166.06 1.26 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.026 -0.534 . . . . 4.4100000000000001 110.021 -178.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -58.79 -26.16 63.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.913 0.387 . . . . 5.3399999999999999 111.554 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -87.27 -7.44 57.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.937 -0.574 . . . . 5.3799999999999999 111.782 -174.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.57 3.65 88.97 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.736 -0.745 . . . . 4.3700000000000001 112.347 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.425 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 93.9 m-20 -71.19 139.64 50.23 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.438 -0.579 . . . . 4.5099999999999998 109.438 175.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.504 ' CD ' ' HE3' ' A' ' 71' ' ' LYS . 34.3 tt0 -72.1 90.39 1.19 Allowed 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.529 -0.545 . . . . 4.2800000000000002 109.529 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.602 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 31.3 m -92.68 99.51 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.168 0 CA-C-O 121.785 0.803 . . . . 3.1000000000000001 109.208 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.578 ' HB ' ' HD2' ' A' ' 71' ' ' LYS . 0.8 OUTLIER -80.03 108.38 9.14 Favored Pre-proline 0 C--N 1.309 -1.165 0 N-CA-C 108.813 -0.81 . . . . 2.5 108.813 175.951 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.491 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 54.0 Cg_exo . . . . . 0 CA--C 1.513 -0.527 0 C-N-CA 123.363 2.709 . . . . 1.8700000000000001 112.953 -170.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 78.3 m-70 . . . . . 0 N--CA 1.449 -0.496 0 N-CA-C 108.69 -0.856 . . . . 0.71999999999999997 108.69 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.426 ' HA ' ' HA ' ' A' ' 61' ' ' ARG . 32.6 ttm -141.34 129.46 22.1 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.396 -0.522 . . . . 0.27000000000000002 110.838 173.127 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.44 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.7 m-85 -118.19 127.42 53.73 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.611 -0.722 . . . . 0.27000000000000002 109.565 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -80.69 153.55 27.82 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 109.825 -0.435 . . . . 1.26 109.825 177.205 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.457 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 22.1 m-85 -133.58 170.3 15.72 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.247 0.546 . . . . 0.32000000000000001 111.543 -174.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -117.51 -13.86 10.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.245 -0.889 . . . . 2.3799999999999999 109.927 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.526 ' HB2' HG23 ' A' ' 96' ' ' VAL . 57.1 m-80 -141.31 126.17 18.13 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.038 0.447 . . . . 1.1000000000000001 110.432 -177.075 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.488 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.5 mmm180 -62.33 -34.13 76.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.413 -0.812 . . . . 3.0899999999999999 111.816 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.7 m -63.05 -32.67 74.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.404 -0.362 . . . . 0.34999999999999998 110.793 -177.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.548 ' O ' HG12 ' A' ' 100' ' ' ILE . 11.8 t -71.04 -57.45 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.23000000000000001 110.284 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.577 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.6 ptp -56.53 -39.07 72.73 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.974 -0.557 . . . . 0.17000000000000001 111.136 -176.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.433 ' N ' ' HG3' ' A' ' 97' ' ' MET . 16.0 t70 -65.13 -39.44 93.04 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.804 -0.358 . . . . 0.34000000000000002 110.36 179.042 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -75.08 -39.9 60.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.247 -0.433 . . . . 1.3600000000000001 111.763 -179.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.548 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.2 mm -63.89 -55.52 21.84 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.361 0 N-CA-C 108.656 -0.868 . . . . 0.12 108.656 176.007 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.814 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.4 ttpt -51.05 -47.51 61.75 Favored 'General case' 0 C--O 1.218 -0.565 0 O-C-N 123.827 0.704 . . . . 0.79000000000000004 109.885 176.662 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.688 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 35.2 ttp -50.33 -56.3 11.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.626 -0.715 . . . . 0.28000000000000003 110.999 177.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.708 ' O ' HG13 ' A' ' 107' ' ' ILE . 40.5 m -58.32 -53.29 59.99 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.482 0.489 . . . . 0.17999999999999999 110.557 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.899 HD13 HD21 ' A' ' 62' ' ' LEU . 25.8 mt -47.23 -54.38 10.95 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.722 -0.672 . . . . 0.089999999999999997 110.631 175.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.549 ' HG2' HD13 ' A' ' 48' ' ' LEU . 53.5 mt-30 -51.25 -46.63 62.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.698 -1.137 . . . . 1.2 112.223 177.08 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 102' ' ' MET . 18.9 mt-30 -60.04 -40.46 89.49 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-O 122.006 0.908 . . . . 2.3700000000000001 108.864 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.708 HG13 ' O ' ' A' ' 103' ' ' THR . 7.4 mt -69.15 -46.5 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 CA-C-N 113.878 -1.51 . . . . 0.14999999999999999 111.165 -178.721 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.576 HD12 HD11 ' A' ' 48' ' ' LEU . 6.0 mt -62.24 -42.19 94.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.223 -0.444 . . . . 0.19 111.635 -177.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.9 t -56.88 -29.69 63.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.655 0.264 . . . . 1.1399999999999999 111.022 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -61.1 -42.11 97.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.459 0.647 . . . . 1.6399999999999999 109.905 176.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -92.43 -3.93 54.49 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.217 -0.901 . . . . 0.65000000000000002 110.22 -178.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 115.316 -0.856 . . . . 0.76000000000000001 108.884 176.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.493 ' HA ' HD12 ' A' ' 18' ' ' ILE . 25.1 m80 . . . . . 0 CA--C 1.513 -0.472 0 N-CA-C 110.071 -0.344 . . . . 0.75 110.071 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 56.9 p -157.24 168.47 27.32 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.184 -0.607 . . . . 1.0900000000000001 111.997 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.471 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 175.83 -169.11 41.72 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.108 -0.951 . . . . 0.16 110.814 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -98.07 129.07 44.92 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 117.237 0.519 . . . . 0.16 110.164 177.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.423 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -143.47 145.68 32.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.866 0.365 . . . . 0.11 111.477 -176.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.47 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 83.1 mt -102.89 129.95 53.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 116.332 -0.394 . . . . 0.33000000000000002 110.091 176.21 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.462 ' O ' HG13 ' A' ' 12' ' ' VAL . 26.0 t80 -141.85 141.02 33.07 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 108.871 -0.788 . . . . 0.35999999999999999 108.871 178.015 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 62.48 24.99 14.9 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.826 -0.435 . . . . 0.80000000000000004 109.826 -176.732 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt 64.61 1.72 1.43 Allowed 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 113.54 0.941 . . . . 2.1099999999999999 113.54 -177.101 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.462 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -95.79 125.51 48.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 108.722 -0.844 . . . . 0.22 108.722 169.633 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.446 ' HA ' HG12 ' A' ' 8' ' ' ILE . 59.4 p -75.6 145.13 41.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.799 0.333 . . . . 1.0700000000000001 110.483 -176.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.462 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -160.82 -160.28 10.57 Favored Glycine 0 N--CA 1.438 -1.169 0 C-N-CA 119.742 -1.218 . . . . 0.11 113.926 -175.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.3 mm -125.71 131.76 71.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 N-CA-C 108.935 -0.765 . . . . 0.13 108.935 -179.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.56 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.33 136.98 33.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 110.272 -0.27 . . . . 0.13 110.272 -176.357 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.72 130.1 31.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.911 0.386 . . . . 0.10000000000000001 111.486 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.52 HG12 HD23 ' A' ' 27' ' ' LEU . 54.7 mt -86.43 135.25 25.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 109.918 -0.401 . . . . 0.27000000000000002 109.918 177.768 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.0 101.06 10.17 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.156 -0.475 . . . . 1.24 110.694 -176.48 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -114.42 169.73 8.83 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.431 -0.581 . . . . 1.2 109.431 176.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t70 76.01 -1.56 2.93 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.966 0.888 . . . . 0.57999999999999996 109.96 -177.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 23' ' ' SER . 31.6 m -102.62 -174.87 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 114.472 -1.24 . . . . 0.25 109.928 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.6 ' O ' HG23 ' A' ' 22' ' ' VAL . 58.3 m -73.84 164.03 64.08 Favored Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 105.045 -2.206 . . . . 1.1299999999999999 105.045 174.05 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -41.18 127.73 2.94 Favored 'Trans proline' 0 C--N 1.352 0.73 0 CA-C-N 121.15 1.446 . . . . 0.16 112.629 -137.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.458 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -51.49 141.27 16.16 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 113.713 -1.585 . . . . 0.10000000000000001 112.164 -165.618 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -125.43 166.76 16.01 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 114.37 -1.286 . . . . 0.32000000000000001 111.844 -170.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -115.53 105.03 12.33 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 107.422 -1.325 . . . . 0.089999999999999997 107.422 173.538 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.8 m -99.03 106.9 19.2 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 120.933 0.397 . . . . 0.17000000000000001 111.056 -176.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -84.48 132.56 34.53 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.907 -0.775 . . . . 0.14000000000000001 108.907 171.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.495 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 66.6 mtt180 -124.6 159.09 31.51 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 108.463 -0.94 . . . . 1.9099999999999999 108.463 174.733 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.0 p -71.96 177.57 4.23 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.987 -0.746 . . . . 0.59999999999999998 108.987 177.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.462 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.2 p -60.19 -33.84 72.79 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.969 -0.692 . . . . 0.26000000000000001 110.898 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -87.73 -31.63 19.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.76 0.79 . . . . 2.1200000000000001 109.394 171.03 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.495 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 93.02 11.02 59.22 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 114.51 -1.223 . . . . 0.23000000000000001 112.29 177.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -60.58 -45.23 94.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.343 -0.614 . . . . 1.73 109.343 173.663 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.5 tttm -83.52 138.68 33.31 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.652 -0.87 . . . . 1.3 108.652 172.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.454 HG23 ' HG2' ' A' ' 30' ' ' ARG . 9.8 p -143.81 139.88 25.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 120.849 0.356 . . . . 0.17000000000000001 110.552 -178.456 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -145.09 115.19 7.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.578 -0.283 . . . . 0.40999999999999998 110.321 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.436 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 50.8 m -108.19 133.74 52.03 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.607 0.595 . . . . 0.14999999999999999 112.607 -174.609 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.35 130.17 52.66 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.587 0 N-CA-C 108.082 -1.081 . . . . 0.12 108.082 168.989 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 45' ' ' ILE . 74.5 t -93.01 120.68 42.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 O-C-N 121.193 -0.942 . . . . 0.11 109.199 173.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.596 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -68.73 -20.5 64.39 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.916 0.71 . . . . 0.080000000000000002 112.916 -170.043 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.5 p -67.49 -18.1 64.93 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.948 -0.76 . . . . 0.87 108.948 176.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.414 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 5.3 p -109.03 14.1 24.22 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.142 -0.936 . . . . 0.14999999999999999 110.07 -177.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.487 HG21 ' CD1' ' A' ' 62' ' ' LEU . 24.7 mm -110.06 138.76 36.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.168 -0.679 . . . . 0.12 109.168 177.279 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.476 ' HB2' ' HG2' ' A' ' 65' ' ' LYS . 37.2 t70 -101.84 -41.58 6.46 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.278 -0.419 . . . . 0.52000000000000002 110.487 -176.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.431 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 13.1 mtmt -144.51 175.75 9.9 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.983 0.42 . . . . 1.4099999999999999 111.255 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.778 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -151.81 140.35 20.65 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.704 -0.85 . . . . 0.72999999999999998 108.704 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -139.72 115.89 10.44 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.047 0.385 . . . . 1.9399999999999999 111.734 -173.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.496 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -111.26 144.84 39.78 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.73 0.3 . . . . 0.22 111.661 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.401 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 61.2 p -64.76 123.71 84.22 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-N 115.827 -0.624 . . . . 0.26000000000000001 110.898 -177.557 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.439 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 35.1 Cg_exo -54.97 157.16 13.76 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.658 2.239 . . . . 0.38 111.417 175.661 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.59 -19.78 65.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.224 -0.444 . . . . 0.66000000000000003 111.814 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 t -93.29 -14.45 26.96 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.166 0.508 . . . . 1.5 110.443 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.439 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 17.6 m -65.95 137.39 57.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.672 -0.695 . . . . 0.84999999999999998 111.299 177.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -50.55 -34.86 27.15 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-N 114.748 -1.115 . . . . 1.77 110.419 172.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.494 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 34.4 mmtt -86.3 149.99 24.66 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 113.449 -1.705 . . . . 1.6299999999999999 112.123 -171.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.403 ' O ' ' HG3' ' A' ' 59' ' ' MET . 4.3 mtp -128.82 98.53 5.0 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.831 -1.077 . . . . 1.1100000000000001 109.238 171.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.51 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.4 OUTLIER -156.49 156.33 33.54 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.651 -0.704 . . . . 0.22 111.045 -171.888 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -129.87 119.07 22.71 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.049 -1.093 . . . . 0.10000000000000001 108.049 175.787 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.519 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 47.9 mtm180 -99.97 141.98 32.06 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.208 0.528 . . . . 2.9900000000000002 110.788 -178.6 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.956 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -120.36 104.62 10.18 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 114.97 -1.014 . . . . 0.13 108.814 177.162 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.521 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.9 mp -84.37 97.21 4.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.285 -0.635 . . . . 0.28999999999999998 109.285 -174.383 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.487 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -72.59 148.68 42.32 Favored Glycine 0 N--CA 1.442 -0.942 0 CA-C-N 115.461 -0.791 . . . . 0.54000000000000004 111.904 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.476 ' HG2' ' HB2' ' A' ' 46' ' ' ASP . 91.9 mttt . . . . . 0 C--N 1.313 -1.001 0 CA-C-O 121.027 0.441 . . . . 0.55000000000000004 111.793 -176.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.67 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 12.7 m-20 . . . . . 0 N--CA 1.449 -0.496 0 N-CA-C 108.384 -0.969 . . . . 3.23 108.384 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.47 -2.88 3.65 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.187 -0.46 . . . . 2.3900000000000001 112.039 -171.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.7 p -67.9 -16.1 63.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.376 0.608 . . . . 2.96 110.336 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.5 ptpt -79.55 42.88 0.53 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.584 -0.735 . . . . 2.4900000000000002 111.188 177.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -44.24 116.68 1.06 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.328 0.585 . . . . 3.3999999999999999 109.921 -176.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.407 ' HG2' ' N ' ' A' ' 73' ' ' LYS . 77.0 ttt180 -105.89 165.83 10.92 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.072 -0.967 . . . . 3.7999999999999998 109.853 -166.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.596 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 61.7 mttp -130.63 139.35 50.38 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.925 -0.398 . . . . 4.29 109.925 170.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.48 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 2.9 p-10 -86.62 -168.6 2.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.017 -0.538 . . . . 4.4100000000000001 110.377 -177.222 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -58.9 -31.2 68.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.705 0.288 . . . . 5.3399999999999999 111.618 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.48 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 16.5 mt-10 -80.18 -14.9 58.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 5.3799999999999999 110.898 -179.013 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.94 16.54 59.43 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.738 -0.744 . . . . 4.3700000000000001 111.695 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.596 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 53.4 m-20 -77.11 138.98 39.84 Favored 'General case' 0 CA--C 1.512 -0.519 0 N-CA-C 109.043 -0.725 . . . . 4.5099999999999998 109.043 178.383 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -69.79 90.08 0.59 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.49 -0.559 . . . . 4.2800000000000002 109.49 176.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 27.9 m -96.32 123.87 48.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.565 0.698 . . . . 3.1000000000000001 110.044 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.468 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 t -90.59 122.47 67.07 Favored Pre-proline 0 C--N 1.313 -1.002 0 N-CA-C 108.452 -0.944 . . . . 2.5 108.452 177.319 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 33.4 Cg_exo . . . . . 0 CA--C 1.513 -0.574 0 C-N-CA 123.009 2.473 . . . . 1.8700000000000001 111.642 -176.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.519 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 52.3 m80 . . . . . 0 C--O 1.22 -0.499 0 N-CA-C 107.785 -1.191 . . . . 0.71999999999999997 107.785 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.51 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 27.6 ttm -140.29 125.91 19.17 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 118.891 0.769 . . . . 0.27000000000000002 111.775 175.364 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.438 ' O ' ' HA ' ' A' ' 59' ' ' MET . 10.1 m-85 -112.82 127.26 56.12 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.39 -0.823 . . . . 0.27000000000000002 109.842 178.553 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.12 149.51 29.13 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.924 0.392 . . . . 1.26 110.284 177.388 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.455 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 25.0 m-85 -131.71 174.16 10.41 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.297 0.57 . . . . 0.32000000000000001 111.533 -174.536 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -119.51 -21.18 7.5 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.017 -0.992 . . . . 2.3799999999999999 109.572 175.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.593 ' HB2' HG23 ' A' ' 96' ' ' VAL . 61.2 m-20 -130.55 126.89 37.9 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.046 -0.525 . . . . 1.1000000000000001 110.525 -173.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.567 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 10.6 mmm180 -64.4 -32.86 74.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.627 -0.715 . . . . 3.0899999999999999 111.874 178.083 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.2 m -62.34 -39.0 91.65 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.89 0.376 . . . . 0.34999999999999998 110.937 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.593 HG23 ' HB2' ' A' ' 93' ' ' ASN . 13.0 t -67.84 -55.21 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-N 116.025 -0.534 . . . . 0.23000000000000001 110.384 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.617 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.2 ptp -59.05 -36.15 74.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.268 -0.424 . . . . 0.17000000000000001 111.05 -176.253 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -64.35 -45.53 87.37 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.55 -0.296 . . . . 0.34000000000000002 110.274 176.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -70.2 -42.91 71.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.999 -0.546 . . . . 1.3600000000000001 111.868 -177.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.599 HG22 HD11 ' A' ' 104' ' ' LEU . 38.8 mm -61.41 -55.93 21.2 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 109.024 -0.732 . . . . 0.12 109.024 178.357 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.813 ' HA ' HD12 ' A' ' 104' ' ' LEU . 21.2 ttpp -51.36 -51.23 56.37 Favored 'General case' 0 C--O 1.218 -0.584 0 O-C-N 123.742 0.652 . . . . 0.79000000000000004 110.05 177.029 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.596 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 45.8 ttp -46.82 -53.45 11.98 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.061 -0.972 . . . . 0.28000000000000003 111.365 177.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.72 ' O ' HG13 ' A' ' 107' ' ' ILE . 20.0 m -62.56 -52.23 64.23 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.201 -0.454 . . . . 0.17999999999999999 110.751 179.381 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.956 HD13 HD21 ' A' ' 62' ' ' LEU . 33.0 mt -47.22 -53.36 13.45 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.646 0.736 . . . . 0.089999999999999997 110.62 175.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.768 ' HG2' HD13 ' A' ' 48' ' ' LEU . 57.4 mt-30 -55.29 -39.8 70.32 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.258 -1.337 . . . . 1.2 112.125 177.43 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.596 ' HG2' ' O ' ' A' ' 102' ' ' MET . 25.9 mm-40 -69.25 -25.67 64.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.556 0.693 . . . . 2.3700000000000001 110.218 178.586 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.72 HG13 ' O ' ' A' ' 103' ' ' THR . 18.4 mt -82.18 -46.15 19.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 114.952 -1.022 . . . . 0.14999999999999999 111.08 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.778 HD12 HD11 ' A' ' 48' ' ' LEU . 11.0 mt -62.68 -40.4 88.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.039 -0.528 . . . . 0.19 111.541 -176.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.5 p -61.44 -20.63 63.32 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.373 -0.376 . . . . 1.1399999999999999 111.802 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -66.28 -51.99 51.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.587 0.708 . . . . 1.6399999999999999 109.309 173.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -78.18 -16.58 57.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.081 -0.963 . . . . 0.65000000000000002 110.374 -178.576 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 115.392 -0.822 . . . . 0.76000000000000001 109.329 174.356 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 70.7 m80 . . . . . 0 N--CA 1.473 0.679 0 N-CA-C 112.235 0.457 . . . . 0.75 112.235 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.0 p -150.63 165.31 33.76 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.089 0.774 . . . . 1.0900000000000001 113.089 -170.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.487 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . -179.76 -161.8 27.65 Favored Glycine 0 N--CA 1.443 -0.862 0 CA-C-N 114.472 -1.24 . . . . 0.16 110.434 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.92 133.53 47.88 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.438 0.619 . . . . 0.16 110.407 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.611 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -147.47 148.1 30.89 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.17 0.433 . . . . 0.11 112.17 -176.333 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.816 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.7 mt -107.66 124.19 63.54 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-O 120.818 0.342 . . . . 0.33000000000000002 110.915 177.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -123.78 133.81 53.76 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.739 -0.837 . . . . 0.35999999999999999 108.739 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 53.95 32.06 14.62 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 122.804 0.441 . . . . 0.80000000000000004 110.947 -177.097 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.4 mtpt 70.98 -1.82 2.55 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.435 0.902 . . . . 2.1099999999999999 113.435 178.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.4 p -92.56 118.78 38.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.792 -0.818 . . . . 0.22 108.792 169.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.412 ' HA ' HG12 ' A' ' 8' ' ' ILE . 79.3 p -72.93 145.93 46.45 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.161 -0.472 . . . . 1.0700000000000001 110.656 -176.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . 0.435 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -163.82 -157.44 9.35 Favored Glycine 0 N--CA 1.439 -1.164 0 C-N-CA 120.106 -1.045 . . . . 0.11 113.214 -177.652 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.1 mm -126.17 132.12 70.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 109.404 -0.591 . . . . 0.13 109.404 -178.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.548 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -100.74 134.89 39.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.859 -0.423 . . . . 0.13 109.859 -177.453 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.4 128.78 28.12 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.502 -0.317 . . . . 0.10000000000000001 111.443 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.426 HD13 ' HB ' ' A' ' 103' ' ' THR . 46.9 mt -85.46 138.67 18.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 121.267 0.556 . . . . 0.27000000000000002 109.973 175.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.403 HD22 ' HA ' ' A' ' 19' ' ' ASN . 0.9 OUTLIER -110.42 103.28 11.9 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 114.917 -1.038 . . . . 1.24 110.947 -175.24 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -116.58 169.05 9.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.319 -0.623 . . . . 1.2 109.319 175.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.7 t70 78.35 -3.31 2.31 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 122.251 1.025 . . . . 0.57999999999999996 109.664 -176.593 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 23' ' ' SER . 27.1 m -102.82 -174.55 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 113.918 -1.492 . . . . 0.25 109.331 178.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.638 ' O ' HG23 ' A' ' 22' ' ' VAL . 64.6 m -72.94 167.92 29.46 Favored Pre-proline 0 C--N 1.314 -0.964 0 N-CA-C 105.404 -2.073 . . . . 1.1299999999999999 105.404 175.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.417 ' O ' HG13 ' A' ' 41' ' ' VAL . 93.7 Cg_exo -41.15 129.34 3.11 Favored 'Trans proline' 0 C--N 1.354 0.82 0 CA-C-N 121.166 1.452 . . . . 0.16 112.531 -141.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -52.83 138.75 28.76 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 114.182 -1.372 . . . . 0.10000000000000001 112.2 -162.493 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -118.89 167.44 11.72 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.094 -0.957 . . . . 0.32000000000000001 111.797 -171.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.796 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -116.75 105.59 12.56 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 106.988 -1.486 . . . . 0.089999999999999997 106.988 170.397 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.411 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.0 m -102.43 106.28 16.99 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 120.885 0.374 . . . . 0.17000000000000001 110.801 -174.677 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -86.29 129.42 34.86 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 109.009 -0.737 . . . . 0.14000000000000001 109.009 173.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.469 ' HG2' HG23 ' A' ' 37' ' ' VAL . 73.4 mtt180 -124.15 157.48 34.57 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.365 -0.976 . . . . 1.9099999999999999 108.365 173.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 p -68.08 175.45 3.16 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.076 -0.712 . . . . 0.59999999999999998 109.076 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.435 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 7.0 p -57.27 -44.27 83.8 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 118.362 0.528 . . . . 0.26000000000000001 110.678 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -82.73 -26.38 32.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.753 -0.658 . . . . 2.1200000000000001 109.719 172.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.13 16.49 47.17 Favored Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.184 -0.916 . . . . 0.23000000000000001 112.885 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -62.16 -54.03 46.85 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.478 -0.564 . . . . 1.73 109.478 174.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt -80.93 140.3 35.37 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.517 -0.765 . . . . 1.3 109.186 176.003 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.469 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.9 p -149.32 134.81 11.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.022 0.439 . . . . 0.17000000000000001 111.078 -178.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -139.83 129.16 24.01 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.484 -0.561 . . . . 0.40999999999999998 109.484 178.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.411 ' OG1' HG23 ' A' ' 28' ' ' THR . 25.1 m -117.56 129.26 55.67 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.262 0.468 . . . . 0.14999999999999999 112.262 -172.259 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.796 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -97.3 128.99 48.02 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.629 0 N-CA-C 107.797 -1.186 . . . . 0.12 107.797 168.775 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.417 HG13 ' O ' ' A' ' 24' ' ' PRO . 68.0 t -92.72 120.8 42.68 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 N-CA-C 108.208 -1.034 . . . . 0.11 108.208 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -67.04 -20.7 65.89 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.19 0.811 . . . . 0.080000000000000002 113.19 -169.036 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.7 p -68.41 -15.53 63.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.225 0.536 . . . . 0.87 109.906 175.574 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.2 p -106.26 9.93 31.91 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.531 -0.758 . . . . 0.14999999999999999 109.874 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.528 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.7 mm -111.9 143.33 21.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.876 -0.602 . . . . 0.12 109.515 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -107.03 -44.69 4.33 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.392 -0.367 . . . . 0.52000000000000002 110.72 -178.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.49 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 9.6 mtmm -138.92 171.53 14.19 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.452 -0.34 . . . . 1.4099999999999999 111.212 -176.172 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.606 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -150.64 135.4 17.4 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.21 -0.663 . . . . 0.72999999999999998 109.21 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.537 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 79.7 mm-40 -131.57 120.11 22.43 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 111.934 0.346 . . . . 1.9399999999999999 111.934 -170.196 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.18 141.93 47.49 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 121.974 -0.454 . . . . 0.22 111.937 -177.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.6 p -68.58 121.96 82.88 Favored Pre-proline 0 N--CA 1.464 0.261 0 CA-C-N 115.848 -0.615 . . . . 0.26000000000000001 110.712 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.465 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 11.1 Cg_exo -59.57 161.08 18.5 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.395 2.063 . . . . 0.38 111.433 175.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.84 -23.51 66.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.003 0.43 . . . . 0.66000000000000003 110.748 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 42.5 m -76.41 -19.26 58.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.641 . . . . 1.5 110.648 176.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.465 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 73.2 m -78.15 134.47 37.65 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.373 -0.831 . . . . 0.84999999999999998 110.316 177.294 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -57.96 -26.49 62.36 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 121.708 0.765 . . . . 1.77 110.673 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.588 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 42.4 mmtm -77.81 151.74 33.81 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 114.56 -1.2 . . . . 1.6299999999999999 111.435 -176.488 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.534 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -127.31 95.57 4.31 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 107.927 -1.138 . . . . 1.1100000000000001 107.927 168.628 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.588 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.13 151.66 28.54 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 121.62 0.724 . . . . 0.22 112.084 -173.537 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.9 tt -127.76 119.32 25.5 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.408 -1.269 . . . . 0.10000000000000001 107.936 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.567 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 30.3 mtm180 -101.01 144.98 29.29 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.111 0.481 . . . . 2.9900000000000002 111.119 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.915 HD21 HD13 ' A' ' 104' ' ' LEU . 1.1 mm? -122.64 106.18 10.74 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.208 -0.905 . . . . 0.13 109.097 178.323 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.527 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -85.34 98.77 6.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.742 -0.466 . . . . 0.28999999999999998 109.742 -173.679 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -74.03 136.73 22.03 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.752 -0.658 . . . . 0.54000000000000004 112.443 -178.189 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.476 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 82.0 mttt . . . . . 0 C--N 1.322 -0.596 0 N-CA-C 112.831 0.678 . . . . 0.55000000000000004 112.831 -176.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.696 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 15.3 t70 . . . . . 0 C--O 1.211 -0.96 0 N-CA-C 109.222 -0.659 . . . . 3.23 109.222 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -65.65 -3.49 4.78 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.676 0.621 . . . . 2.3900000000000001 112.676 -169.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.0 p -75.89 -7.93 55.7 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.26 0.552 . . . . 2.96 110.239 170.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.696 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.9 ptmt -80.17 37.45 0.38 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.44 -0.8 . . . . 2.4900000000000002 110.719 176.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.532 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 29.8 mmtm -45.23 114.54 0.75 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.945 -0.571 . . . . 3.3999999999999999 110.354 -175.231 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.0 ttt180 -91.26 158.88 16.33 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 107.909 -1.145 . . . . 3.7999999999999998 107.909 -176.415 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 97.3 mttt -134.4 140.56 46.38 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 109.535 -0.543 . . . . 4.29 109.535 174.737 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.46 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 1.6 p-10 -80.14 -169.46 2.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.126 -0.488 . . . . 4.4100000000000001 110.527 -177.098 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -58.53 -31.75 68.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.727 0.298 . . . . 5.3399999999999999 111.662 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.519 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 16.5 mt-10 -83.7 -32.42 25.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.744 0.307 . . . . 5.3799999999999999 110.921 -178.009 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 113.78 18.24 7.04 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.594 -0.813 . . . . 4.3700000000000001 112.32 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.519 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 32.2 m-80 -76.11 131.81 39.65 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.172 -0.677 . . . . 4.5099999999999998 109.172 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.08 96.38 0.62 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.098 0.475 . . . . 4.2800000000000002 109.932 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.7 m -105.45 99.32 8.24 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-O 121.605 0.716 . . . . 3.1000000000000001 109.077 177.441 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.532 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -87.53 121.31 71.16 Favored Pre-proline 0 C--N 1.312 -1.033 0 CA-C-N 116.078 -0.51 . . . . 2.5 110.2 -177.723 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.447 ' HG2' ' HE2' ' A' ' 70' ' ' LYS . 52.1 Cg_exo . . . . . 0 N--CA 1.458 -0.608 0 C-N-CA 122.975 2.45 . . . . 1.8700000000000001 112.135 -178.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.567 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 70.0 m80 . . . . . 0 CA--C 1.509 -0.604 0 N-CA-C 107.497 -1.297 . . . . 0.71999999999999997 107.497 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 35.2 ttm -140.4 127.11 20.4 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 119.687 -0.805 . . . . 0.27000000000000002 111.666 179.063 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.596 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.0 m-85 -118.11 130.04 55.9 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.418 -0.81 . . . . 0.27000000000000002 109.536 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.816 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -79.71 159.33 26.68 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.718 -0.475 . . . . 1.26 109.718 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.475 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 28.8 m-85 -138.73 175.33 9.65 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 120.752 0.311 . . . . 0.32000000000000001 110.765 -178.641 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -124.02 -12.3 7.49 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.851 -0.613 . . . . 2.3799999999999999 109.823 173.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.536 ' HB2' HG23 ' A' ' 96' ' ' VAL . 46.6 m-80 -138.06 128.3 26.03 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.067 -0.515 . . . . 1.1000000000000001 110.252 -177.595 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.55 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 13.9 mmm180 -67.24 -30.23 70.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.528 -0.76 . . . . 3.0899999999999999 111.85 -179.604 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.9 m -61.88 -39.8 93.18 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.979 0.418 . . . . 0.34999999999999998 110.549 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.578 ' O ' HG12 ' A' ' 100' ' ' ILE . 8.1 t -65.92 -56.03 16.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.899 -0.591 . . . . 0.23000000000000001 110.4 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.583 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.8 ptp -57.44 -38.03 73.78 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 116.235 -0.439 . . . . 0.17000000000000001 111.067 -176.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.53 -43.58 93.54 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.449 -0.5 . . . . 0.34000000000000002 110.466 177.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -70.65 -39.28 73.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.141 -0.482 . . . . 1.3600000000000001 111.585 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.606 HG22 HD11 ' A' ' 104' ' ' LEU . 34.0 mm -63.89 -56.99 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 108.895 -0.779 . . . . 0.12 108.895 175.754 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.797 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.1 ttpt -49.99 -48.75 52.2 Favored 'General case' 0 C--O 1.22 -0.47 0 O-C-N 123.926 0.766 . . . . 0.79000000000000004 109.793 176.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.684 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 41.9 ttp -49.09 -56.36 9.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.54 -0.755 . . . . 0.28000000000000003 111.201 177.553 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.728 ' O ' HG13 ' A' ' 107' ' ' ILE . 32.3 m -58.5 -53.49 57.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.15 -0.477 . . . . 0.17999999999999999 110.596 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.915 HD13 HD21 ' A' ' 62' ' ' LEU . 26.1 mt -47.5 -53.61 13.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.705 -0.68 . . . . 0.089999999999999997 110.569 175.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.571 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.9 mt-30 -53.36 -44.06 68.27 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.524 -1.216 . . . . 1.2 112.182 176.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.684 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.2 mt-30 -62.95 -35.75 81.16 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.753 0.787 . . . . 2.3700000000000001 109.086 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.728 HG13 ' O ' ' A' ' 103' ' ' THR . 9.3 mt -74.43 -45.63 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-N 114.326 -1.307 . . . . 0.14999999999999999 111.417 -177.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.551 HD12 HD11 ' A' ' 48' ' ' LEU . 8.8 mt -63.8 -40.66 89.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.449 -0.341 . . . . 0.19 111.699 -177.242 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.7 t -56.31 -24.76 45.66 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.979 0.418 . . . . 1.1399999999999999 111.045 -178.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -65.65 -40.94 93.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.214 0.53 . . . . 1.6399999999999999 110.255 176.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -90.9 -16.78 27.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.635 -0.711 . . . . 0.65000000000000002 109.984 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.427 0 CA-C-N 115.135 -0.939 . . . . 0.76000000000000001 109.215 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.424 ' CD2' HG21 ' A' ' 103' ' ' THR . 39.3 m80 . . . . . 0 CA--C 1.519 -0.242 0 CA-C-O 120.86 0.362 . . . . 0.75 110.17 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.0 p -143.79 168.23 20.43 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.967 0.413 . . . . 1.0900000000000001 111.541 -174.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.476 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 179.77 -159.01 23.18 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 110.824 -0.911 . . . . 0.16 110.824 -178.381 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.5 135.72 47.52 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 117.133 0.467 . . . . 0.16 110.176 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.542 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -151.68 140.78 21.22 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.043 0.386 . . . . 0.11 112.043 -177.139 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.751 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 87.0 mt -99.32 126.76 52.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.838 -0.43 . . . . 0.33000000000000002 109.838 173.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -125.95 135.19 51.57 Favored 'General case' 0 C--O 1.215 -0.731 0 N-CA-C 108.433 -0.951 . . . . 0.35999999999999999 108.433 178.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 57.98 26.04 12.97 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 122.68 0.392 . . . . 0.80000000000000004 110.754 -177.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm 69.46 1.04 3.15 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.876 0.695 . . . . 2.1099999999999999 112.876 -177.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.6 p -92.54 120.81 42.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 108.55 -0.907 . . . . 0.22 108.55 168.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.468 ' HA ' HG12 ' A' ' 8' ' ' ILE . 16.2 p -74.84 143.14 44.05 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.749 -0.66 . . . . 1.0700000000000001 111.266 -174.52 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.82 -158.59 9.79 Favored Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.461 -0.876 . . . . 0.11 113.436 -177.26 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.412 HG23 ' O ' ' A' ' 5' ' ' GLY . 20.4 mm -127.78 132.6 68.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 C-N-CA 123.396 0.679 . . . . 0.13 109.362 -176.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.505 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -101.61 135.41 38.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.903 -0.406 . . . . 0.13 109.903 -176.708 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.15 130.21 28.62 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.499 0.19 . . . . 0.10000000000000001 111.433 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.439 HD13 ' HB ' ' A' ' 103' ' ' THR . 53.8 mt -85.35 136.47 22.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.365 0.603 . . . . 0.27000000000000002 109.921 175.334 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -108.47 99.7 9.06 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.935 -1.03 . . . . 1.24 111.038 -173.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.511 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 23.8 mt-10 -112.31 171.14 7.69 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.421 -0.955 . . . . 1.2 108.421 174.278 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.511 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 33.7 t70 79.68 -6.37 1.8 Allowed 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 122.44 1.114 . . . . 0.57999999999999996 109.499 -177.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 23' ' ' SER . 23.4 m -103.53 -171.44 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 113.76 -1.564 . . . . 0.25 109.943 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.675 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.2 p -72.02 168.62 21.24 Favored Pre-proline 0 C--N 1.319 -0.737 0 N-CA-C 105.31 -2.107 . . . . 1.1299999999999999 105.31 174.735 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' PRO . . . . . 0.434 ' O ' HG13 ' A' ' 41' ' ' VAL . 72.8 Cg_exo -41.17 128.4 3.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 CA-C-N 121.594 1.605 . . . . 0.16 112.511 -146.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.539 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -49.2 139.9 10.41 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 114.195 -1.366 . . . . 0.10000000000000001 112.482 -164.104 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -121.69 168.96 11.19 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 114.687 -1.142 . . . . 0.32000000000000001 111.375 -170.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.887 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.99 107.02 13.54 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 107.141 -1.429 . . . . 0.089999999999999997 107.141 170.258 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.572 HG23 ' OG1' ' A' ' 39' ' ' THR . 3.3 m -103.84 106.51 17.04 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-O 120.795 0.331 . . . . 0.17000000000000001 110.875 -174.639 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.5 t90 -85.76 129.56 34.79 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 108.853 -0.795 . . . . 0.14000000000000001 108.853 172.538 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.562 ' HG2' HG23 ' A' ' 37' ' ' VAL . 97.9 mtt180 -124.97 157.43 36.12 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.871 -0.789 . . . . 1.9099999999999999 108.871 174.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -69.84 176.26 3.78 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.849 -0.426 . . . . 0.59999999999999998 109.849 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.2 p -61.45 -30.58 70.67 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.237 -0.585 . . . . 0.26000000000000001 111.258 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -94.94 -20.25 19.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.494 0.664 . . . . 2.1200000000000001 109.626 171.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 84.7 17.15 64.31 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 114.824 -1.08 . . . . 0.23000000000000001 112.635 177.328 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -67.38 -51.07 56.44 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.191 -0.67 . . . . 1.73 109.191 173.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -78.84 139.09 38.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.892 -0.781 . . . . 1.3 108.892 173.255 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.562 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.7 p -149.14 136.23 13.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 120.913 0.387 . . . . 0.17000000000000001 110.739 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -144.2 127.0 16.25 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.77 -0.456 . . . . 0.40999999999999998 109.77 177.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.572 ' OG1' HG23 ' A' ' 28' ' ' THR . 31.4 m -117.63 132.93 56.43 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.406 0.521 . . . . 0.14999999999999999 112.406 -172.52 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.887 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -99.88 129.45 50.49 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 107.93 -1.137 . . . . 0.12 107.93 168.422 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.434 HG13 ' O ' ' A' ' 24' ' ' PRO . 93.3 t -93.25 121.59 44.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 O-C-N 121.044 -1.035 . . . . 0.11 108.544 172.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.577 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -67.37 -21.24 65.62 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.32 0.859 . . . . 0.080000000000000002 113.32 -169.051 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.1 p -69.37 -13.74 62.53 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.223 -0.591 . . . . 0.87 109.673 175.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . 0.431 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 3.8 p -110.75 11.79 22.55 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.384 -0.826 . . . . 0.14999999999999999 109.785 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.526 HG21 ' CD1' ' A' ' 62' ' ' LEU . 26.6 mm -110.75 140.76 28.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.071 -0.714 . . . . 0.12 109.071 177.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.411 ' HB2' ' HG2' ' A' ' 65' ' ' LYS . 38.8 t70 -104.8 -41.73 5.56 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.344 -0.389 . . . . 0.52000000000000002 110.934 -177.656 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.495 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 9.7 mtmm -140.82 171.73 13.68 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.768 0.318 . . . . 1.4099999999999999 111.247 -177.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.601 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -150.45 146.48 26.68 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.518 -0.919 . . . . 0.72999999999999998 108.518 177.622 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.584 ' HG3' HD11 ' A' ' 63' ' ' ILE . 4.1 mt-30 -142.68 120.96 12.28 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 121.211 -0.195 . . . . 1.9399999999999999 110.943 -174.298 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.477 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -117.2 152.16 35.37 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.9 -0.5 . . . . 0.22 111.467 -179.116 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.544 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 70.5 p -77.64 119.53 77.78 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.884 -0.598 . . . . 0.26000000000000001 110.786 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.536 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 9.9 Cg_exo -60.7 165.47 11.63 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 122.711 2.274 . . . . 0.38 112.015 175.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.77 -21.29 63.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.146 0.498 . . . . 0.66000000000000003 110.692 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 70.6 m -78.91 -16.94 56.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.758 -0.655 . . . . 1.5 110.961 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.536 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 30.1 m -77.32 142.07 39.59 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.802 0.811 . . . . 0.84999999999999998 112.512 -177.06 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -55.4 -30.63 60.76 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 113.921 -1.49 . . . . 1.77 110.93 172.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.495 ' HB3' HG21 ' A' ' 51' ' ' THR . 3.0 mptp? -93.27 156.2 16.96 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 114.025 -1.443 . . . . 1.6299999999999999 111.966 -173.06 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.544 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 73.6 mmm -132.52 98.66 4.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.464 -0.789 . . . . 1.1100000000000001 109.206 168.754 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.495 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.0 OUTLIER -158.18 159.49 36.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.573 -0.74 . . . . 0.22 111.395 -170.286 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.6 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.5 tt -134.81 120.14 19.01 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.819 -0.808 . . . . 0.10000000000000001 108.819 177.609 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.451 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 1.9 mtp180 -105.33 146.46 29.35 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.1 0.476 . . . . 2.9900000000000002 111.787 -176.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.913 HD21 HD13 ' A' ' 104' ' ' LEU . 1.1 mm? -127.4 114.67 17.83 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.088 -0.96 . . . . 0.13 109.648 -177.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.584 HD11 ' HG3' ' A' ' 49' ' ' GLN . 1.8 mp -90.74 102.26 13.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 120.936 0.398 . . . . 0.28999999999999998 110.826 -172.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.488 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -70.56 137.0 26.79 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.732 -0.667 . . . . 0.54000000000000004 111.972 178.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.431 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 90.5 mttt . . . . . 0 C--N 1.319 -0.74 0 CA-C-O 121.305 0.574 . . . . 0.55000000000000004 112.39 -175.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 . . . . . 0 N--CA 1.449 -0.498 0 N-CA-C 109.416 -0.587 . . . . 3.23 109.416 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -76.14 -2.47 31.19 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.275 0.559 . . . . 2.3900000000000001 110.465 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 p -92.13 2.2 56.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.692 -0.686 . . . . 2.96 109.952 172.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.538 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 4.3 ptmm? -90.57 20.56 4.52 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.588 -0.733 . . . . 2.4900000000000002 110.285 -178.469 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.2 mtmt -40.95 114.9 0.52 Allowed 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.765 0.793 . . . . 3.3999999999999999 111.031 -158.309 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 78.3 ttt180 -88.38 163.93 15.77 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.345 -1.298 . . . . 3.7999999999999998 109.131 -168.164 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 93.4 mttt -129.49 143.1 50.69 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.287 -0.634 . . . . 4.29 109.287 172.072 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 40.5 p30 -82.25 -167.43 1.57 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.301 -0.409 . . . . 4.4100000000000001 110.766 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -69.42 -20.47 63.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.776 0.322 . . . . 5.3399999999999999 111.56 -177.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -89.12 -28.17 20.25 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.039 0.447 . . . . 5.3799999999999999 109.966 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 109.89 16.99 10.01 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.97 -0.633 . . . . 4.3700000000000001 111.912 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.474 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 24.2 m120 -78.46 138.94 38.71 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.51 -0.552 . . . . 4.5099999999999998 109.51 178.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -70.15 102.03 1.99 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.29 -0.633 . . . . 4.2800000000000002 109.29 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.578 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 15.8 m -113.43 98.69 7.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-O 121.791 0.805 . . . . 3.1000000000000001 109.281 177.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.4 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 p -92.1 112.81 56.81 Favored Pre-proline 0 C--N 1.315 -0.903 0 CA-C-O 121.256 0.551 . . . . 2.5 110.154 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.492 ' HG2' ' HD3' ' A' ' 70' ' ' LYS . 87.9 Cg_exo . . . . . 0 CA--C 1.518 -0.318 0 C-N-CA 123.683 2.922 . . . . 1.8700000000000001 112.985 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 74.9 m80 . . . . . 0 C--O 1.222 -0.372 0 N-CA-C 108.082 -1.081 . . . . 0.71999999999999997 108.082 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.495 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 28.0 ttm -141.02 140.16 34.26 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 118.278 0.49 . . . . 0.27000000000000002 110.586 174.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.542 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 13.4 m-85 -125.38 158.53 34.06 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 108.468 -0.938 . . . . 0.27000000000000002 108.468 171.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.751 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 5.2 p -99.12 160.42 14.28 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 109.136 -0.69 . . . . 1.26 109.136 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' PHE . . . . . 0.6 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 38.5 m-85 -145.87 162.82 36.86 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.156 0.503 . . . . 0.32000000000000001 111.746 176.056 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -123.08 0.5 9.08 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.486 -0.779 . . . . 2.3799999999999999 109.836 174.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.443 ' HB2' HG23 ' A' ' 96' ' ' VAL . 48.2 m-80 -146.85 126.82 13.63 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.661 -0.7 . . . . 1.1000000000000001 109.922 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.633 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.8 mmm180 -66.26 -38.59 88.19 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.184 -0.462 . . . . 3.0899999999999999 111.584 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.3 m -62.45 -24.22 67.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.05 0.453 . . . . 0.34999999999999998 110.505 -175.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.624 ' O ' HG12 ' A' ' 100' ' ' ILE . 11.9 t -76.14 -59.58 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 N-CA-C 109.537 -0.542 . . . . 0.23000000000000001 109.537 173.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.633 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.2 ptp -58.23 -41.78 84.86 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.602 -0.272 . . . . 0.17000000000000001 111.161 -176.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.518 ' N ' ' HG3' ' A' ' 97' ' ' MET . 32.4 t70 -60.61 -40.81 93.2 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.097 -0.641 . . . . 0.34000000000000002 110.39 177.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 14.0 m-20 -74.12 -40.91 62.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.177 -0.465 . . . . 1.3600000000000001 111.744 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 96' ' ' VAL . 34.4 mm -61.08 -56.96 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.333 0 N-CA-C 108.51 -0.922 . . . . 0.12 108.51 175.196 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.799 ' HA ' HD12 ' A' ' 104' ' ' LEU . 30.0 ttpt -50.96 -50.17 58.62 Favored 'General case' 0 C--O 1.216 -0.674 0 O-C-N 124.033 0.833 . . . . 0.79000000000000004 109.72 177.041 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.494 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.5 ttp -49.91 -55.31 14.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.757 -0.656 . . . . 0.28000000000000003 111.273 178.212 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.728 ' O ' HG13 ' A' ' 107' ' ' ILE . 53.6 m -57.44 -54.58 45.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.136 -0.484 . . . . 0.17999999999999999 110.353 178.45 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.913 HD13 HD21 ' A' ' 62' ' ' LEU . 26.8 mt -46.97 -56.13 6.94 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 123.333 0.653 . . . . 0.089999999999999997 110.714 176.316 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.55 ' HG2' HD13 ' A' ' 48' ' ' LEU . 60.0 mt-30 -49.47 -47.43 48.45 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.693 -1.139 . . . . 1.2 112.032 177.382 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 102' ' ' MET . 82.7 mm-40 -65.99 -36.78 84.23 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.786 0.803 . . . . 2.3700000000000001 109.903 -177.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.728 HG13 ' O ' ' A' ' 103' ' ' THR . 8.3 mt -69.12 -44.38 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 CA-C-N 114.526 -1.216 . . . . 0.14999999999999999 110.721 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.0 mt -64.56 -43.51 96.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.188 -0.46 . . . . 0.19 111.315 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.7 t -55.05 -28.51 52.81 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.213 0.32 . . . . 1.1399999999999999 111.144 -178.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 106' ' ' GLN . 91.8 mtt180 -60.5 -51.02 71.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.482 0.658 . . . . 1.6399999999999999 109.671 175.099 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -80.88 -15.13 57.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.339 -0.846 . . . . 0.65000000000000002 110.468 -179.041 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.488 0 N-CA-C 109.074 -0.713 . . . . 0.76000000000000001 109.074 175.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' HIS . . . . . 0.594 ' HB2' HD12 ' A' ' 18' ' ' ILE . 22.4 p-80 . . . . . 0 CA--C 1.512 -0.507 0 CA-C-O 121.829 0.823 . . . . 0.75 109.412 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 55.0 p -160.46 148.25 16.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.09 -0.959 . . . . 1.0900000000000001 110.584 171.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.421 ' O ' HG23 ' A' ' 15' ' ' ILE . . . -175.21 -153.81 10.58 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.105 -0.798 . . . . 0.16 111.105 -177.0 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.63 140.28 38.26 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 117.09 0.445 . . . . 0.16 110.001 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ALA . . . . . 0.453 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -152.04 144.36 24.02 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.071 0.462 . . . . 0.11 111.506 -178.505 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.576 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 81.8 mt -109.75 106.59 21.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.063 -0.517 . . . . 0.33000000000000002 110.415 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -106.3 138.65 42.1 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 108.762 -0.829 . . . . 0.35999999999999999 108.762 -178.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 53.66 22.17 2.96 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.912 0.485 . . . . 0.80000000000000004 111.504 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt 66.97 16.84 10.44 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.906 -0.588 . . . . 2.1099999999999999 111.724 -178.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.438 HG13 ' CH2' ' A' ' 29' ' ' TRP . 2.3 p -102.52 117.35 47.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 107.467 -1.309 . . . . 0.22 107.467 163.429 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -74.4 145.32 43.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.994 0.425 . . . . 1.0700000000000001 111.093 -172.659 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -166.49 -159.38 12.17 Favored Glycine 0 N--CA 1.437 -1.299 0 C-N-CA 120.111 -1.043 . . . . 0.11 113.408 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.421 HG23 ' O ' ' A' ' 5' ' ' GLY . 14.7 mm -124.89 132.09 71.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 114.94 -0.63 . . . . 0.13 109.475 -176.626 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.531 HD11 HD11 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -101.24 134.16 42.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.794 -0.447 . . . . 0.13 109.794 -177.696 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.29 124.37 22.95 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.364 -0.38 . . . . 0.10000000000000001 110.933 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ILE . . . . . 0.634 HG12 HD23 ' A' ' 27' ' ' LEU . 22.8 mt -84.58 127.17 40.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.385 -0.598 . . . . 0.27000000000000002 109.385 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -97.7 101.87 13.48 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.864 -0.607 . . . . 1.24 110.533 -173.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -116.41 169.05 9.61 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.136 -0.69 . . . . 1.2 109.136 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.9 t70 75.92 -1.63 2.93 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 122.151 0.977 . . . . 0.57999999999999996 109.971 -177.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 23' ' ' SER . 32.7 m -103.06 -173.89 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 114.249 -1.341 . . . . 0.25 109.848 179.223 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.635 ' O ' HG23 ' A' ' 22' ' ' VAL . 47.8 m -72.92 167.51 33.28 Favored Pre-proline 0 C--N 1.319 -0.753 0 N-CA-C 105.157 -2.164 . . . . 1.1299999999999999 105.157 173.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -41.53 126.82 3.15 Favored 'Trans proline' 0 C--N 1.357 0.974 0 CA-C-N 121.413 1.54 . . . . 0.16 112.27 -140.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -51.35 140.76 16.6 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-N 114.227 -1.351 . . . . 0.10000000000000001 112.371 -165.484 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -124.33 169.13 12.1 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 114.126 -1.397 . . . . 0.32000000000000001 111.506 -169.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.68 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -117.32 104.61 11.32 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.471 -1.307 . . . . 0.089999999999999997 107.471 173.499 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.428 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.6 m -100.07 106.16 17.88 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 120.795 -0.362 . . . . 0.17000000000000001 110.593 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.438 ' CH2' HG13 ' A' ' 12' ' ' VAL . 81.6 t90 -87.07 131.48 34.11 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.697 -0.853 . . . . 0.14000000000000001 108.697 171.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.501 ' HG2' HG23 ' A' ' 37' ' ' VAL . 72.3 mtt180 -126.01 158.58 34.96 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.969 -0.752 . . . . 1.9099999999999999 108.969 174.402 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.9 p -68.42 173.11 5.2 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.789 -0.819 . . . . 0.59999999999999998 108.789 177.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -56.17 -40.67 74.25 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.572 -0.451 . . . . 0.26000000000000001 111.398 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -87.83 -22.91 24.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.581 0.705 . . . . 2.1200000000000001 109.824 173.415 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.449 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 92.73 16.84 47.1 Favored Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 114.964 -1.016 . . . . 0.23000000000000001 112.481 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -59.83 -51.8 68.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.293 0.568 . . . . 1.73 109.52 173.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -88.29 144.01 26.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.306 -0.861 . . . . 1.3 109.24 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' VAL . . . . . 0.501 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.6 p -149.3 138.12 15.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.806 0.336 . . . . 0.17000000000000001 110.941 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -144.09 121.46 11.65 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.645 -0.502 . . . . 0.40999999999999998 109.645 177.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 48.1 m -110.79 130.47 55.57 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 111.955 0.354 . . . . 0.14999999999999999 111.955 -175.447 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.68 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -99.56 129.76 49.62 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.77 0 N-CA-C 108.253 -1.018 . . . . 0.12 108.253 169.996 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.426 ' O ' HG12 ' A' ' 45' ' ' ILE . 64.5 t -92.79 119.03 39.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 O-C-N 121.144 -0.973 . . . . 0.11 108.875 173.241 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.546 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -67.25 -16.47 64.3 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 112.47 0.545 . . . . 0.080000000000000002 112.47 -171.202 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.532 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 96.8 p -71.66 -14.36 62.02 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.26 -0.644 . . . . 0.87 109.26 176.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.3 p -110.1 6.6 22.99 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.321 -0.854 . . . . 0.14999999999999999 109.871 -179.032 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.509 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 27.9 mm -107.83 141.33 23.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.652 -0.704 . . . . 0.12 109.268 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -99.29 -45.42 5.88 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.249 -0.432 . . . . 0.52000000000000002 110.449 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.522 ' C ' HD22 ' A' ' 48' ' ' LEU . 10.5 mtmm -141.86 174.05 10.94 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.372 0.606 . . . . 1.4099999999999999 111.83 -175.436 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.768 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -137.56 152.59 49.6 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 107.261 -1.385 . . . . 0.72999999999999998 107.261 174.488 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.423 ' HG2' HD11 ' A' ' 63' ' ' ILE . 15.7 mm-40 -144.05 118.95 9.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.298 0.499 . . . . 1.9399999999999999 110.618 179.038 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.51 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -116.67 141.57 48.02 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 122.195 -0.316 . . . . 0.22 111.444 -178.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.425 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 81.3 p -68.74 119.78 71.39 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 115.952 -0.567 . . . . 0.26000000000000001 110.753 -175.351 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.529 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 7.7 Cg_exo -60.56 163.43 15.45 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.646 2.231 . . . . 0.38 112.125 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.01 -21.73 66.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.707 -0.679 . . . . 0.66000000000000003 111.576 -177.211 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.9 m -96.51 6.31 48.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.009 -0.541 . . . . 1.5 110.673 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.529 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 42.7 m -89.62 145.52 25.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.009 -0.541 . . . . 0.84999999999999998 110.839 174.182 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -53.73 -23.39 11.57 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 114.935 -1.03 . . . . 1.77 111.666 175.799 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.627 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 43.2 mmtm -105.2 161.53 14.19 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 114.326 -1.306 . . . . 1.6299999999999999 112.397 -164.228 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.435 ' HB3' ' HE3' ' A' ' 58' ' ' MET . 83.9 mmm -131.68 97.21 4.15 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.847 -1.07 . . . . 1.1100000000000001 108.528 166.529 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.627 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.2 OUTLIER -154.14 157.37 38.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.191 0.519 . . . . 0.22 111.676 -172.99 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.7 tt -133.63 119.59 19.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.478 -0.934 . . . . 0.10000000000000001 108.478 177.797 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.58 ' HG2' ' HB2' ' A' ' 88' ' ' MET . 8.4 mtp180 -103.88 140.88 37.06 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.219 0.533 . . . . 2.9900000000000002 111.552 -178.431 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.98 HD21 HD13 ' A' ' 104' ' ' LEU . 1.8 mm? -115.36 111.52 20.97 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.935 -1.029 . . . . 0.13 109.599 176.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ILE . . . . . 0.556 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -91.71 98.35 8.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.354 -0.384 . . . . 0.28999999999999998 110.519 -169.59 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.424 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -68.18 144.23 42.54 Favored Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.666 -0.697 . . . . 0.54000000000000004 112.039 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.509 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 81.5 mttt . . . . . 0 C--N 1.315 -0.904 0 N-CA-C 113.213 0.82 . . . . 0.55000000000000004 113.213 -173.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.728 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 22.7 t70 . . . . . 0 C--O 1.214 -0.784 0 N-CA-C 109.175 -0.676 . . . . 3.23 109.175 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -62.8 -6.71 3.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.621 0.6 . . . . 2.3900000000000001 112.621 -170.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -77.07 -4.08 42.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.069 0.462 . . . . 2.96 110.757 172.595 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.728 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.0 ptmt -82.2 41.93 0.71 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.852 -0.613 . . . . 2.4900000000000002 110.326 175.014 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.577 ' HE2' ' OE1' ' A' ' 79' ' ' GLU . 23.5 mmtm -44.49 115.11 0.79 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.594 -0.73 . . . . 3.3999999999999999 110.437 -176.295 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.665 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 77.7 ttt180 -95.68 165.87 12.1 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 107.708 -1.219 . . . . 3.7999999999999998 107.708 -176.321 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -128.6 131.95 48.16 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 118.904 0.775 . . . . 4.29 111.215 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -73.21 172.14 11.68 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.449 -1.25 . . . . 4.4100000000000001 110.236 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -51.79 -31.54 27.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.955 0.407 . . . . 5.3399999999999999 111.405 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -94.18 15.87 16.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.38 -0.373 . . . . 5.3799999999999999 111.694 -176.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.51 11.77 80.18 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.348 -0.387 . . . . 4.3700000000000001 113.016 176.072 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -73.51 131.9 42.28 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.244 -0.651 . . . . 4.5099999999999998 109.244 176.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLU . . . . . 0.577 ' OE1' ' HE2' ' A' ' 71' ' ' LYS . 26.8 tt0 -68.09 95.28 0.55 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.61 -0.515 . . . . 4.2800000000000002 109.61 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' VAL . . . . . 0.665 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 10.8 m -102.5 99.46 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 CA-C-O 121.732 0.777 . . . . 3.1000000000000001 109.277 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.532 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.1 p -82.61 117.76 69.58 Favored Pre-proline 0 C--N 1.308 -1.239 0 CA-C-N 115.704 -0.68 . . . . 2.5 109.776 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PRO . . . . . 0.545 ' HG2' ' HE2' ' A' ' 70' ' ' LYS . 52.9 Cg_exo . . . . . 0 CA--C 1.511 -0.653 0 C-N-CA 123.282 2.655 . . . . 1.8700000000000001 112.725 -174.445 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' HIS . . . . . 0.58 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 58.2 m-70 . . . . . 0 C--O 1.218 -0.58 0 N-CA-C 108.598 -0.89 . . . . 0.71999999999999997 108.598 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.58 ' HB2' ' HG2' ' A' ' 61' ' ' ARG . 20.1 ttm -108.4 122.1 46.3 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 119.736 -0.786 . . . . 0.27000000000000002 111.654 -175.154 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.453 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 5.9 m-85 -112.08 130.75 55.78 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.035 -0.984 . . . . 0.27000000000000002 109.65 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' SER . . . . . 0.576 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -80.99 151.6 28.39 Favored 'General case' 0 C--N 1.316 -0.886 0 O-C-N 122.035 -0.415 . . . . 1.26 110.526 177.122 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -133.52 174.39 10.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.231 -0.441 . . . . 0.32000000000000001 111.149 -175.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -115.71 -22.16 9.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.547 -0.751 . . . . 2.3799999999999999 111.032 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -141.37 142.29 33.78 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.969 0.414 . . . . 1.1000000000000001 110.528 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ARG . . . . . 0.655 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.0 mmm180 -67.61 -33.22 74.54 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.581 -0.736 . . . . 3.0899999999999999 111.326 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.6 m -59.9 -38.75 83.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.17 -0.468 . . . . 0.34999999999999998 110.512 -175.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.573 ' O ' HG12 ' A' ' 100' ' ' ILE . 6.6 t -67.71 -56.06 14.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.19 -0.459 . . . . 0.23000000000000001 109.952 177.416 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' MET . . . . . 0.655 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.4 ptp -60.12 -41.09 91.88 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.422 -0.354 . . . . 0.17000000000000001 111.2 -177.016 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ASP . . . . . 0.463 ' N ' ' HG3' ' A' ' 97' ' ' MET . 24.6 t70 -61.96 -39.04 90.78 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 120.0 -0.68 . . . . 0.34000000000000002 110.534 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -72.96 -43.92 61.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.38 -0.373 . . . . 1.3600000000000001 111.393 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.613 HG22 HD11 ' A' ' 104' ' ' LEU . 33.2 mm -60.49 -56.02 20.51 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 N-CA-C 108.703 -0.851 . . . . 0.12 108.703 176.101 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.911 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.4 ttpt -52.43 -48.35 65.81 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 115.403 -0.817 . . . . 0.79000000000000004 109.836 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.695 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 32.3 ttp -47.56 -59.47 3.23 Favored 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 123.812 0.695 . . . . 0.28000000000000003 111.099 176.511 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' THR . . . . . 0.78 ' O ' HG13 ' A' ' 107' ' ' ILE . 24.3 m -56.41 -50.43 71.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.939 -0.573 . . . . 0.17999999999999999 110.227 -178.628 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.98 HD13 HD21 ' A' ' 62' ' ' LEU . 25.8 mt -49.0 -56.15 9.82 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 121.342 0.591 . . . . 0.089999999999999997 110.232 175.096 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.768 ' HG2' HD23 ' A' ' 48' ' ' LEU . 27.8 mt-30 -52.18 -43.12 64.0 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.778 -1.101 . . . . 1.2 112.177 176.475 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' A' ' 102' ' ' MET . 84.5 mt-30 -66.07 -38.95 89.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 122.035 0.922 . . . . 2.3700000000000001 109.013 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ILE . . . . . 0.78 HG13 ' O ' ' A' ' 103' ' ' THR . 7.8 mt -72.73 -45.57 56.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 114.196 -1.365 . . . . 0.14999999999999999 111.531 -177.476 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ILE . . . . . 0.591 HG13 ' O ' ' A' ' 104' ' ' LEU . 19.1 mt -58.67 -44.07 89.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 112.226 0.454 . . . . 0.19 112.226 -176.502 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' SER . . . . . 0.65 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 12.6 t -66.49 -15.69 63.56 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.776 -0.37 . . . . 1.1399999999999999 111.865 -176.938 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -59.42 -35.5 74.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.619 0.723 . . . . 1.6399999999999999 109.129 168.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.532 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 33.7 m-85 -97.14 -16.93 20.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.905 -1.043 . . . . 0.65000000000000002 110.61 -177.541 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LYS . . . . . 0.65 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 9.1 mmpt? . . . . . 0 C--N 1.329 -0.307 0 N-CA-C 109.155 -0.684 . . . . 0.76000000000000001 109.155 172.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo . . . . . 0 N--CA 1.478 0.593 0 N-CA-C 110.604 -0.575 . . . . 1.8899999999999999 110.604 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.2 t -69.89 -32.39 70.71 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.239 -0.437 . . . . 2.0499999999999998 111.189 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.564 ' HA ' HD12 ' A' ' 18' ' ' ILE . 76.5 m80 69.06 -10.81 0.49 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.224 0.609 . . . . 0.75 112.217 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.1 p -147.77 161.59 40.94 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 119.807 -0.757 . . . . 1.0900000000000001 112.212 -177.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.45 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -177.82 -166.21 34.01 Favored Glycine 0 N--CA 1.44 -1.063 0 CA-C-N 114.803 -1.089 . . . . 0.16 110.413 -178.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.16 132.98 44.08 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 117.432 0.616 . . . . 0.16 110.241 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.482 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -144.58 145.51 31.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.952 0.406 . . . . 0.11 111.578 -176.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.468 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 84.4 mt -110.84 111.05 34.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.26 -0.427 . . . . 0.33000000000000002 110.246 178.357 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -112.51 137.33 50.89 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.714 -0.847 . . . . 0.35999999999999999 108.714 -178.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 57.1 23.28 8.31 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.966 0.412 . . . . 0.80000000000000004 110.479 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt 68.6 6.48 5.48 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.237 -0.892 . . . . 2.1099999999999999 112.741 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.401 HG13 ' CH2' ' A' ' 29' ' ' TRP . 1.5 p -94.04 122.16 45.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 108.025 -1.102 . . . . 0.22 108.025 166.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.9 p -76.21 142.49 41.47 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.896 0.379 . . . . 1.0700000000000001 111.293 -173.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.463 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -160.72 -157.72 8.88 Favored Glycine 0 N--CA 1.437 -1.282 0 C-N-CA 120.325 -0.941 . . . . 0.11 113.083 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 24.6 mm -126.66 135.58 63.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.095 -0.706 . . . . 0.13 109.095 -178.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.532 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.27 135.84 40.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.972 -0.381 . . . . 0.13 109.972 -176.428 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.98 126.71 25.5 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.846 0.355 . . . . 0.10000000000000001 111.642 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.564 HD12 ' HA ' ' A' ' 3' ' ' HIS . 71.0 mt -85.24 134.38 27.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.023 0.439 . . . . 0.27000000000000002 109.988 177.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -105.49 102.22 11.7 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.806 -0.633 . . . . 1.24 110.847 -175.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 23.9 mt-10 -116.66 169.68 9.17 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.166 -0.679 . . . . 1.2 109.166 174.625 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 26.6 t0 77.5 -1.32 2.71 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.474 1.131 . . . . 0.57999999999999996 109.513 -175.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 23' ' ' SER . 30.0 m -104.56 -174.67 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 113.762 -1.563 . . . . 0.25 109.766 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.618 ' O ' HG23 ' A' ' 22' ' ' VAL . 43.1 m -73.59 169.46 18.34 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 105.46 -2.052 . . . . 1.1299999999999999 105.46 174.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo -41.77 128.62 3.83 Favored 'Trans proline' 0 C--N 1.359 1.08 0 CA-C-N 121.624 1.616 . . . . 0.16 112.095 -143.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.483 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -55.77 143.1 32.17 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 114.194 -1.367 . . . . 0.10000000000000001 112.198 -161.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.99 167.83 14.77 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 114.715 -1.129 . . . . 0.32000000000000001 111.92 -170.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.66 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -118.09 107.86 14.51 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.627 -1.249 . . . . 0.089999999999999997 107.627 175.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 m -102.97 106.5 17.04 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.772 0.32 . . . . 0.17000000000000001 110.875 -175.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.401 ' CH2' HG13 ' A' ' 12' ' ' VAL . 84.4 t90 -87.16 131.8 34.06 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.888 -0.782 . . . . 0.14000000000000001 108.888 171.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.466 ' HG2' HG23 ' A' ' 37' ' ' VAL . 60.0 mtt180 -126.36 157.88 37.31 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.918 -0.771 . . . . 1.9099999999999999 108.918 174.294 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -67.12 172.79 4.26 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.184 -0.673 . . . . 0.59999999999999998 109.184 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.463 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.2 p -57.59 -32.36 67.09 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.323 -0.551 . . . . 0.26000000000000001 111.242 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -93.58 -32.18 14.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.581 0.705 . . . . 2.1200000000000001 109.546 172.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.443 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 99.59 17.39 26.36 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 114.921 -1.036 . . . . 0.23000000000000001 112.693 177.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.82 -29.37 66.63 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.269 0.557 . . . . 1.73 109.743 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -103.1 141.2 36.24 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.536 -0.912 . . . . 1.3 108.536 173.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.466 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.0 p -149.98 140.39 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.719 -0.392 . . . . 0.17000000000000001 111.489 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -144.47 125.45 14.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.435 . . . . 0.40999999999999998 109.969 177.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 26.4 m -111.21 133.48 53.52 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 111.876 0.324 . . . . 0.14999999999999999 111.876 -175.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.66 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.08 127.73 58.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.297 -1.001 . . . . 0.12 108.297 168.996 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.2 t -92.25 119.19 39.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 O-C-N 121.11 -0.994 . . . . 0.11 108.863 173.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.612 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.28 -16.58 64.01 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.433 0.531 . . . . 0.080000000000000002 112.433 -170.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.557 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 92.9 p -70.03 -14.8 62.85 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.32 -0.622 . . . . 0.87 109.32 175.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.3 p -112.76 11.13 19.33 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.103 -0.953 . . . . 0.14999999999999999 110.188 -178.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.544 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 26.7 mm -108.13 139.84 28.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.5 -0.555 . . . . 0.12 109.5 178.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -102.13 -43.83 5.62 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.194 -0.457 . . . . 0.52000000000000002 110.604 -177.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.1 mtmm -139.58 171.75 13.79 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.069 0.461 . . . . 1.4099999999999999 110.867 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.728 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -150.31 151.95 33.71 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.383 -0.969 . . . . 0.72999999999999998 108.383 178.482 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.487 ' HG3' HD11 ' A' ' 63' ' ' ILE . 2.3 mt-30 -139.02 145.98 40.3 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 109.777 -0.453 . . . . 1.9399999999999999 109.777 -177.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.537 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -137.74 132.81 33.32 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 122.09 -0.381 . . . . 0.22 110.24 174.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.471 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 64.1 p -60.18 118.62 34.85 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.74 -0.664 . . . . 0.26000000000000001 110.803 -176.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.451 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 24.6 Cg_exo -54.61 159.75 8.25 Favored 'Trans proline' 0 N--CA 1.464 -0.214 0 C-N-CA 122.776 2.318 . . . . 0.38 112.191 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.82 -21.27 66.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.011 -0.54 . . . . 0.66000000000000003 111.007 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.2 p -83.42 -16.72 44.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.964 -0.562 . . . . 1.5 111.05 176.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.451 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 56.0 m -77.3 134.77 38.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.919 -0.582 . . . . 0.84999999999999998 111.323 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -56.53 -32.84 65.49 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 114.999 -1.0 . . . . 1.77 110.11 172.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.459 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 35.7 mmtm -75.62 151.67 37.77 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.367 -1.288 . . . . 1.6299999999999999 111.471 -176.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.471 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 5.3 mtp -131.31 98.76 4.63 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.257 -0.883 . . . . 1.1100000000000001 109.454 169.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.462 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.3 OUTLIER -158.02 158.06 34.13 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.485 -0.78 . . . . 0.22 111.38 -171.613 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.567 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -133.31 119.6 19.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.873 -1.058 . . . . 0.10000000000000001 108.2 176.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.591 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.8 mtp180 -103.13 145.68 29.55 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.273 0.559 . . . . 2.9900000000000002 111.476 -178.233 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.947 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -127.76 107.37 9.83 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.919 -1.037 . . . . 0.13 108.992 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.554 HG13 ' HG2' ' A' ' 86' ' ' ARG . 2.3 mp -88.49 103.8 14.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.745 0.307 . . . . 0.28999999999999998 110.826 -171.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.446 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -67.01 144.08 44.34 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.107 -0.497 . . . . 0.54000000000000004 112.164 178.216 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.544 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 84.6 mttt -66.51 124.79 23.77 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.488 0.551 . . . . 0.55000000000000004 112.488 -176.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.633 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.3 t -119.42 132.73 68.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 115.239 -0.891 . . . . 1.73 110.415 173.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.859 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 10.4 t70 -81.98 105.02 12.76 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 114.319 -1.31 . . . . 3.23 109.107 174.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -87.52 -2.62 58.74 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.021 0.378 . . . . 2.3900000000000001 112.021 -175.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.2 p -68.76 -18.24 64.18 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.573 0.701 . . . . 2.96 109.612 175.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.859 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 2.7 ptpp? -84.16 35.3 0.53 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.196 -0.911 . . . . 2.4900000000000002 110.943 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -45.16 115.07 0.83 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.413 0.625 . . . . 3.3999999999999999 110.139 -176.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.55 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 78.1 ttt180 -90.48 159.25 16.62 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.884 -1.053 . . . . 3.7999999999999998 108.664 -171.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mtpt -124.74 131.34 53.46 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 119.824 -0.75 . . . . 4.29 110.637 174.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.9 167.5 4.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.765 -1.107 . . . . 4.4100000000000001 110.692 177.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -55.15 -32.86 62.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.756 0.312 . . . . 5.3399999999999999 111.31 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 12.9 mm-40 -86.98 11.98 12.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.962 0.411 . . . . 5.3799999999999999 111.537 179.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.17 32.0 65.95 Favored Glycine 0 N--CA 1.452 -0.287 0 CA-C-N 115.972 -0.558 . . . . 4.3700000000000001 113.051 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -89.52 130.61 35.82 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.23 -0.656 . . . . 4.5099999999999998 109.23 174.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -64.51 104.2 0.76 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.569 -0.53 . . . . 4.2800000000000002 109.569 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.55 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 7.4 m -120.63 97.91 5.56 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 122.022 0.915 . . . . 3.1000000000000001 109.518 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.446 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 p -90.42 126.71 55.55 Favored Pre-proline 0 C--N 1.31 -1.13 0 CA-C-N 115.339 -0.846 . . . . 2.5 110.195 -175.067 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.45 ' HG2' ' CD ' ' A' ' 70' ' ' LYS . 78.4 Cg_exo -53.43 136.03 62.37 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.993 2.462 . . . . 1.8700000000000001 112.449 -176.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.456 ' HD3' ' N ' ' A' ' 83' ' ' LYS . 2.4 mppt? -95.44 146.09 30.7 Favored Pre-proline 0 C--N 1.314 -0.961 0 CA-C-N 115.552 -0.749 . . . . 2.7400000000000002 109.108 178.145 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.633 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 23.5 Cg_exo -59.35 144.3 99.45 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.342 2.028 . . . . 0.83999999999999997 111.272 179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -86.81 115.28 24.13 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.683 0.754 . . . . 1.5700000000000001 109.826 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.554 ' HG2' HG13 ' A' ' 63' ' ' ILE . 61.2 mtt180 -104.07 125.71 50.62 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 114.959 -1.019 . . . . 2.52 111.172 -170.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.556 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 82.0 m-70 -93.43 144.85 24.95 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 107.088 -1.449 . . . . 0.71999999999999997 107.088 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.591 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 19.9 ttm -140.99 124.21 16.52 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 118.904 0.775 . . . . 0.27000000000000002 111.067 176.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.482 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.4 m-85 -113.94 128.17 56.28 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.227 -0.897 . . . . 0.27000000000000002 109.641 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.468 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -80.4 152.27 28.94 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.925 -0.398 . . . . 1.26 109.925 177.732 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.453 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 19.9 m-85 -133.55 171.94 13.42 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.298 0.571 . . . . 0.32000000000000001 111.835 -173.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -122.73 -8.03 8.48 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.035 -0.984 . . . . 2.3799999999999999 110.894 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -146.01 128.31 15.81 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.213 0.53 . . . . 1.1000000000000001 110.777 -176.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.443 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 8.6 mmm180 -63.24 -38.58 91.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.105 -0.952 . . . . 3.0899999999999999 112.183 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.419 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 86.8 m -60.98 -36.3 79.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.816 0.341 . . . . 0.34999999999999998 110.739 -178.17 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.617 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.0 t -67.41 -55.17 18.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.367 -0.379 . . . . 0.23000000000000001 110.471 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.567 ' HA ' HD12 ' A' ' 60' ' ' LEU . 12.3 ptp -60.39 -36.54 78.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 0.17000000000000001 111.128 -176.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 102' ' ' MET . 23.2 t70 -66.96 -42.96 84.29 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.544 -0.463 . . . . 0.34000000000000002 110.132 177.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.454 ' O ' ' HB3' ' A' ' 102' ' ' MET . 1.5 t-20 -67.2 -44.95 78.33 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.437 0.46 . . . . 1.3600000000000001 111.185 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.617 HG12 ' O ' ' A' ' 96' ' ' VAL . 33.6 mm -61.44 -56.36 18.32 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 109.412 -0.588 . . . . 0.12 109.412 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.871 ' HA ' HD12 ' A' ' 104' ' ' LEU . 18.9 ttpp -52.72 -44.57 66.44 Favored 'General case' 0 C--O 1.216 -0.678 0 O-C-N 123.529 0.518 . . . . 0.79000000000000004 110.028 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.516 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 40.1 ttp -51.34 -54.17 28.93 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.075 -0.966 . . . . 0.28000000000000003 111.24 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.754 ' O ' HG13 ' A' ' 107' ' ' ILE . 99.0 m -62.94 -51.31 67.41 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.419 -0.355 . . . . 0.17999999999999999 110.877 178.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.947 HD13 HD21 ' A' ' 62' ' ' LEU . 29.5 mt -46.68 -53.52 11.51 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.728 0.775 . . . . 0.089999999999999997 110.514 175.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.6 ' CG ' HD13 ' A' ' 48' ' ' LEU . 23.0 mt-30 -54.84 -41.96 71.36 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.366 -1.288 . . . . 1.2 112.345 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' A' ' 102' ' ' MET . 14.7 mm100 -64.19 -33.65 76.29 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.915 0.864 . . . . 2.3700000000000001 109.841 178.078 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.754 HG13 ' O ' ' A' ' 103' ' ' THR . 14.9 mt -76.59 -46.16 31.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.25 -1.341 . . . . 0.14999999999999999 111.426 -177.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.728 HD12 HD11 ' A' ' 48' ' ' LEU . 8.8 mt -62.31 -41.39 91.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.312 -0.404 . . . . 0.19 111.976 -176.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.427 ' HA ' ' HB2' ' A' ' 112' ' ' LYS . 33.1 t -57.79 -25.58 60.75 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.711 0.291 . . . . 1.1399999999999999 111.028 -177.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 76.9 mtt180 -64.78 -39.8 94.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.368 0.604 . . . . 1.6399999999999999 109.879 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.557 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 32.5 m-85 -93.84 -10.17 34.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.545 -0.752 . . . . 0.65000000000000002 110.193 -179.115 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.427 ' HB2' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER -71.46 -34.73 70.48 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.523 -0.917 . . . . 0.76000000000000001 108.523 174.627 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.03 -39.89 63.26 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 115.325 -0.852 . . . . 2.27 109.577 172.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -90.47 49.46 1.68 Allowed 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.115 -0.948 . . . . 1.2 110.731 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.1 t70 . . . . . 0 C--O 1.248 0.978 0 CA-C-N 115.456 -0.793 . . . . 2.7200000000000002 110.656 -179.161 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.711 0 N-CA-C 112.071 -0.411 . . . . 19.890000000000001 112.071 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 24.7 t 55.22 76.08 0.54 Allowed Pre-proline 0 C--O 1.234 0.261 0 C-N-CA 122.82 0.448 . . . . 18.329999999999998 111.077 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -64.37 -25.27 63.93 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.785 2.323 . . . . 17.390000000000001 112.408 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -118.63 157.75 15.1 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.867 -0.682 . . . . 16.359999999999999 111.648 178.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 44.2 p90 -162.66 133.8 3.71 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.869 0.366 . . . . 16.0 110.503 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.39 -158.4 0.09 OUTLIER 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.97 2.447 . . . . 13.15 112.271 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -59.21 -56.51 21.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.51 -0.314 . . . . 12.359999999999999 111.085 -179.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 169.13 95.31 0.1 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 119.936 -1.126 . . . . 9.6300000000000008 113.117 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.6 29.54 6.23 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.407 0.623 . . . . 8.3399999999999999 110.311 173.316 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 99.1 mt -67.81 -8.7 38.16 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.382 -0.826 . . . . 10.41 111.88 -176.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 529' ' ' SER . . . . . 0.401 ' HB3' ' OE2' ' B' ' 532' ' ' GLU . 29.4 t -99.13 -49.99 4.31 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.085 -0.507 . . . . 7.6200000000000001 109.633 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 99.45 11.35 44.99 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.86 -0.686 . . . . 5.1900000000000004 112.473 173.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -114.89 -4.88 12.58 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.784 0.802 . . . . 5.5 109.331 -176.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 532' ' ' GLU . . . . . 0.401 ' OE2' ' HB3' ' B' ' 529' ' ' SER . 48.5 mp0 -74.09 -13.43 60.83 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 114.477 -1.238 . . . . 5.6799999999999997 110.365 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -86.9 -11.0 51.99 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 113.69 -1.596 . . . . 3.2200000000000002 110.338 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -77.47 -3.01 38.25 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.229 0.537 . . . . 4.2699999999999996 110.498 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 11.1 p -68.13 -12.63 61.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.745 -0.661 . . . . 1.25 109.835 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 536' ' ' SER . . . . . 0.523 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 79.5 p -74.46 -33.85 63.01 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.549 -0.751 . . . . 2.0800000000000001 110.053 175.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 27.5 mm -80.72 -37.65 16.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.883 -0.599 . . . . 1.29 110.059 175.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -73.43 1.02 10.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.772 0.796 . . . . 0.76000000000000001 110.533 175.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.523 ' HB3' ' O ' ' B' ' 536' ' ' SER . 14.1 t70 -84.84 -44.74 12.96 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.796 -1.093 . . . . 1.23 109.431 172.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 13.9 tmm? -59.13 -39.53 82.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.003 -0.999 . . . . 2.29 109.113 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 541' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 3.6 t70 -51.61 -51.23 57.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.909 -1.041 . . . . 1.1799999999999999 110.423 175.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.406 ' CD2' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -65.57 -41.22 93.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.174 -0.921 . . . . 0.56000000000000005 111.25 -174.634 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 9.1 t -60.78 -35.67 77.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.901 -0.59 . . . . 1.5800000000000001 110.18 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -71.9 -35.34 69.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.932 -0.576 . . . . 0.83999999999999997 111.061 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 94.7 mt -65.58 -44.47 86.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.028 -0.533 . . . . 1.0800000000000001 111.875 -176.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 546' ' ' LEU . . . . . 0.414 HD11 ' HB3' ' A' ' 49' ' ' GLN . 48.0 mt -69.67 -25.94 64.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.219 0.533 . . . . 0.96999999999999997 110.398 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 50.8 p -90.14 13.49 14.95 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.656 -0.702 . . . . 1.4199999999999999 111.554 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -78.21 -1.32 32.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.66 0.266 . . . . 2.6699999999999999 110.69 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 65.7 mt 71.87 -62.75 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 115.493 -0.776 . . . . 5.2300000000000004 110.314 -177.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.9 m -69.57 139.14 53.68 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.761 -0.459 . . . . 6.4000000000000004 109.761 175.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 551' ' ' SER . . . . . 0.437 ' HA ' ' HB3' ' A' ' 52' ' ' PRO . 39.8 m . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.649 -0.691 . . . . 7.5899999999999999 110.505 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo . . . . . 0 N--CA 1.479 0.63 0 N-CA-C 110.849 -0.481 . . . . 1.8899999999999999 110.849 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 3' ' ' HIS . 38.4 t -69.16 -32.73 72.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.957 -0.565 . . . . 2.0499999999999998 110.735 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.406 ' CD2' HG21 ' A' ' 103' ' ' THR . 68.6 m80 70.44 -12.45 0.52 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.881 0.696 . . . . 0.75 112.881 177.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 p -146.53 167.24 24.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.647 0.737 . . . . 1.0900000000000001 112.962 -172.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.49 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 176.01 -165.97 36.86 Favored Glycine 0 N--CA 1.445 -0.761 0 CA-C-N 114.511 -1.222 . . . . 0.16 110.049 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.81 135.69 38.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 118.017 0.908 . . . . 0.16 110.461 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.54 146.71 32.51 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.014 0.435 . . . . 0.11 111.111 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.569 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 52.2 mt -110.38 111.06 34.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.911 -0.586 . . . . 0.33000000000000002 110.054 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -112.57 132.32 55.18 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 108.598 -0.89 . . . . 0.35999999999999999 108.598 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 58.51 25.2 12.76 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 120.962 0.411 . . . . 0.80000000000000004 110.539 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.7 mtpt 68.98 4.12 4.36 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.551 -0.75 . . . . 2.1099999999999999 112.901 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.404 ' O ' ' HZ2' ' A' ' 29' ' ' TRP . 1.2 p -92.37 115.25 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 107.697 -1.224 . . . . 0.22 107.697 166.465 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.0 m -71.92 145.75 48.28 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.057 -0.52 . . . . 1.0700000000000001 110.82 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.73 -158.76 10.57 Favored Glycine 0 N--CA 1.433 -1.538 0 C-N-CA 119.914 -1.136 . . . . 0.11 113.196 -177.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.7 mm -126.18 132.03 70.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 109.336 -0.616 . . . . 0.13 109.336 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.502 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -100.49 134.93 38.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.721 -0.474 . . . . 0.13 109.721 -177.559 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.11 128.18 27.7 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.416 -0.356 . . . . 0.10000000000000001 111.054 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.2 mt -85.1 138.07 19.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.387 0.613 . . . . 0.27000000000000002 109.932 175.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -106.93 99.4 8.97 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 114.808 -1.087 . . . . 1.24 110.299 -176.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -113.97 169.71 8.8 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.317 -0.623 . . . . 1.2 109.317 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.2 t70 76.16 -2.1 2.81 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 122.107 0.956 . . . . 0.57999999999999996 109.857 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 23' ' ' SER . 34.6 m -103.2 -173.59 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.156 -1.384 . . . . 0.25 109.742 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.629 ' O ' HG23 ' A' ' 22' ' ' VAL . 28.4 m -72.68 167.31 34.57 Favored Pre-proline 0 C--N 1.318 -0.79 0 N-CA-C 105.065 -2.198 . . . . 1.1299999999999999 105.065 173.088 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -42.09 127.71 3.99 Favored 'Trans proline' 0 C--N 1.355 0.896 0 CA-C-N 121.279 1.492 . . . . 0.16 112.412 -140.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -50.53 138.57 17.34 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 113.942 -1.481 . . . . 0.10000000000000001 112.399 -166.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -123.39 168.77 12.1 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 114.259 -1.337 . . . . 0.32000000000000001 111.817 -170.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.72 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.15 106.5 13.4 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.324 -1.361 . . . . 0.089999999999999997 107.324 172.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.3 m -102.52 106.22 16.89 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 120.887 0.375 . . . . 0.17000000000000001 110.785 -176.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.404 ' HZ2' ' O ' ' A' ' 12' ' ' VAL . 81.5 t90 -85.24 132.14 34.32 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.781 -0.822 . . . . 0.14000000000000001 108.781 172.391 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.464 ' HG2' HG23 ' A' ' 37' ' ' VAL . 57.1 mtt180 -125.84 158.27 35.46 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.023 -0.732 . . . . 1.9099999999999999 109.023 174.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.2 p -69.84 175.99 3.96 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 109.305 -0.628 . . . . 0.59999999999999998 109.305 178.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 p -59.89 -38.3 81.85 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.231 -0.588 . . . . 0.26000000000000001 111.034 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.0 -29.89 24.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.776 0.798 . . . . 2.1200000000000001 109.36 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.426 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 94.66 16.41 42.56 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 114.737 -1.12 . . . . 0.23000000000000001 112.331 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -69.11 -40.07 78.57 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.433 -0.58 . . . . 1.73 109.433 176.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -87.89 139.42 30.53 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.799 -0.815 . . . . 1.3 108.799 171.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.464 HG23 ' HG2' ' A' ' 30' ' ' ARG . 13.6 p -149.1 137.86 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.811 0.338 . . . . 0.17000000000000001 110.828 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -144.5 123.16 12.54 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.756 -0.461 . . . . 0.40999999999999998 109.756 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 49.2 m -112.81 131.94 55.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.732 0.641 . . . . 0.14999999999999999 112.732 -174.045 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.72 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -99.31 131.03 47.38 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.597 0 N-CA-C 108.035 -1.098 . . . . 0.12 108.035 168.259 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.418 ' O ' HG12 ' A' ' 45' ' ' ILE . 63.9 t -93.86 121.38 44.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 O-C-N 121.122 -0.986 . . . . 0.11 108.843 171.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.61 -19.77 64.46 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.157 0.799 . . . . 0.080000000000000002 113.157 -169.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.3 p -69.43 -14.44 62.89 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.05 -0.66 . . . . 0.87 109.681 175.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -109.62 10.54 24.96 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.599 -0.728 . . . . 0.14999999999999999 110.076 -178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.533 HG21 ' CD1' ' A' ' 62' ' ' LEU . 24.6 mm -111.48 141.09 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 108.871 -0.788 . . . . 0.12 108.871 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -106.91 -43.67 4.6 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.908 0.385 . . . . 0.52000000000000002 110.636 -177.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.455 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 1.0 OUTLIER -134.31 165.81 24.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.042 -0.526 . . . . 1.4099999999999999 110.744 -174.822 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.78 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -150.32 132.35 15.26 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.706 -0.85 . . . . 0.72999999999999998 108.706 177.816 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -134.91 123.11 22.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.969 -0.382 . . . . 1.9399999999999999 109.969 -172.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -115.93 143.15 45.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.321 0.509 . . . . 0.22 110.907 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.622 HG21 ' HB3' ' A' ' 57' ' ' LYS . 62.0 p -61.73 120.78 59.72 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 115.884 -0.598 . . . . 0.26000000000000001 110.859 -177.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.423 ' HD2' ' HB3' ' A' ' 55' ' ' SER . 24.6 Cg_exo -55.29 157.11 15.0 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.556 2.17 . . . . 0.38 111.445 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.23 -9.03 14.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.854 0.359 . . . . 0.66000000000000003 111.854 -177.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.9 p -104.76 -9.46 18.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 1.5 111.829 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.596 ' OG ' ' HB ' ' A' ' 51' ' ' THR . 89.5 p -64.83 151.89 44.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.062 0.458 . . . . 0.84999999999999998 111.092 -178.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.502 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 65.4 mt-10 -59.2 -22.7 61.43 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.823 0.82 . . . . 1.77 110.231 171.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.622 ' HB3' HG21 ' A' ' 51' ' ' THR . 9.9 mptt -101.43 169.42 8.88 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 114.27 -1.332 . . . . 1.6299999999999999 112.838 -170.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.448 ' O ' ' HG3' ' A' ' 59' ' ' MET . 65.7 mmm -141.44 98.34 3.34 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.474 -1.239 . . . . 1.1100000000000001 108.109 165.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.455 ' CE ' ' HG2' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -157.52 160.31 38.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.685 -0.689 . . . . 0.22 111.346 -169.733 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.536 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -131.99 120.38 22.37 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.046 -0.979 . . . . 0.10000000000000001 108.481 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.531 HH22 ' HB2' ' B' ' 539' ' ' ASP . 3.6 mmt85 -99.95 131.62 45.8 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 120.992 0.425 . . . . 2.9900000000000002 110.37 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.943 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -112.84 106.44 14.76 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.563 -0.744 . . . . 0.13 109.0 175.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 4.7 mp -92.32 105.7 16.97 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 120.955 0.407 . . . . 0.28999999999999998 111.163 -171.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.533 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -63.04 164.36 28.29 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.356 -0.838 . . . . 0.54000000000000004 112.626 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.404 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.7 mttt -81.72 120.09 24.68 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.567 0.699 . . . . 0.55000000000000004 112.567 -176.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.624 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.4 t -120.7 138.48 51.03 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 114.555 -1.202 . . . . 1.73 109.471 170.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.803 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 22.1 t70 -87.38 84.86 7.13 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 109.292 -0.632 . . . . 3.23 109.292 178.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.4 -2.65 6.58 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.109 0.411 . . . . 2.3900000000000001 112.109 -172.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.9 p -80.18 -0.99 38.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.934 0.397 . . . . 2.96 110.716 171.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.803 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.4 ptpt -86.85 39.05 0.83 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.112 -0.495 . . . . 2.4900000000000002 110.154 173.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.532 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 24.7 mmtm -43.71 113.81 0.56 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.982 -0.554 . . . . 3.3999999999999999 110.366 -175.022 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.649 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 56.8 ttt180 -90.71 161.53 15.31 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.075 -1.083 . . . . 3.7999999999999998 108.075 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 95.7 mttt -135.29 144.97 47.06 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 118.188 0.449 . . . . 4.29 110.053 175.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.453 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER -78.88 179.92 6.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.933 -0.576 . . . . 4.4100000000000001 109.559 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -56.33 -29.76 61.73 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 111.913 0.338 . . . . 5.3399999999999999 111.913 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.453 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 17.6 mt-10 -81.22 -40.83 23.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.855 0.359 . . . . 5.3799999999999999 110.83 -178.638 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.22 15.47 2.05 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.427 -0.892 . . . . 4.3700000000000001 112.835 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.538 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 41.0 m-80 -74.04 132.07 41.98 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.664 -0.495 . . . . 4.5099999999999998 109.664 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -74.48 92.93 2.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.127 0.489 . . . . 4.2800000000000002 110.028 -178.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.649 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 7.5 m -102.65 99.46 8.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.833 0.825 . . . . 3.1000000000000001 109.227 -179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.532 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.85 125.57 62.25 Favored Pre-proline 0 C--N 1.312 -1.051 0 CA-C-N 115.886 -0.597 . . . . 2.5 110.492 -176.279 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -59.76 140.06 91.52 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.852 2.368 . . . . 1.8700000000000001 111.998 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.44 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -94.91 144.02 27.13 Favored Pre-proline 0 C--N 1.314 -0.964 0 CA-C-N 115.672 -0.694 . . . . 2.7400000000000002 109.501 178.71 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.624 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 24.6 Cg_exo -60.51 150.72 79.87 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.76 2.307 . . . . 0.83999999999999997 111.135 178.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -81.06 113.79 19.49 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.296 0.57 . . . . 1.5700000000000001 109.547 -175.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 63' ' ' ILE . 87.5 mtt180 -101.3 115.82 31.39 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.498 -0.774 . . . . 2.52 110.535 -172.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.471 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 50.9 m80 -94.56 112.04 23.8 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.258 -0.883 . . . . 0.71999999999999997 109.348 -173.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.525 ' CB ' ' HD3' ' A' ' 61' ' ' ARG . 23.2 ttm -101.92 132.82 47.49 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.374 -0.53 . . . . 0.27000000000000002 111.261 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -121.66 129.64 52.92 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.252 -0.648 . . . . 0.27000000000000002 109.252 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.569 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -80.69 153.6 27.79 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 120.943 0.401 . . . . 1.26 110.186 176.687 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.499 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 21.2 m-85 -135.75 166.07 24.12 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.298 0.571 . . . . 0.32000000000000001 111.195 -175.17 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -114.61 -19.32 11.16 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.198 -0.91 . . . . 2.3799999999999999 109.869 176.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.549 ' HB2' HG23 ' A' ' 96' ' ' VAL . 18.7 m120 -134.89 123.66 23.79 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.884 -0.598 . . . . 1.1000000000000001 110.788 -174.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.53 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 14.6 mmm180 -63.04 -34.25 77.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.337 -0.847 . . . . 3.0899999999999999 112.236 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.4 m -62.16 -34.62 76.74 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.955 0.407 . . . . 0.34999999999999998 110.777 -178.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.571 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.2 t -70.13 -58.01 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-N 116.03 -0.532 . . . . 0.23000000000000001 110.265 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.536 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.3 ptp -55.32 -38.42 68.69 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.15 -0.477 . . . . 0.17000000000000001 111.052 -177.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.429 ' N ' ' HG3' ' A' ' 97' ' ' MET . 30.1 t70 -63.9 -45.65 88.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.647 0.261 . . . . 0.34000000000000002 110.448 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -71.69 -35.25 70.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.088 -0.505 . . . . 1.3600000000000001 111.887 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.663 HG22 HD11 ' A' ' 104' ' ' LEU . 28.2 mm -66.95 -57.47 9.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 108.472 -0.936 . . . . 0.12 108.472 175.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.773 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.7 ttpt -48.0 -50.39 27.7 Favored 'General case' 0 C--O 1.219 -0.522 0 O-C-N 124.223 0.952 . . . . 0.79000000000000004 109.899 176.393 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.693 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 48.1 ttp -48.19 -57.55 5.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.227 -0.897 . . . . 0.28000000000000003 111.2 177.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.729 ' O ' HG13 ' A' ' 107' ' ' ILE . 45.1 m -58.45 -53.77 54.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.413 -0.358 . . . . 0.17999999999999999 110.73 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.943 HD13 HD21 ' A' ' 62' ' ' LEU . 22.7 mt -47.21 -53.77 12.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.492 0.663 . . . . 0.089999999999999997 110.561 176.054 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.661 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.7 mt-30 -53.66 -42.04 67.45 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.611 -1.177 . . . . 1.2 112.372 176.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.693 ' HG3' ' O ' ' A' ' 102' ' ' MET . 36.5 mt-30 -66.03 -31.65 72.67 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.782 0.801 . . . . 2.3700000000000001 109.194 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.729 HG13 ' O ' ' A' ' 103' ' ' THR . 15.0 mt -77.35 -45.1 29.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 114.597 -1.183 . . . . 0.14999999999999999 111.289 -177.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.78 HD12 HD11 ' A' ' 48' ' ' LEU . 9.8 mt -65.24 -38.45 82.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.166 -0.47 . . . . 0.19 112.177 -175.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.401 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 3.8 p -59.54 -26.49 65.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.878 0.37 . . . . 1.1399999999999999 110.986 -179.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -60.63 -50.58 72.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.79 0.805 . . . . 1.6399999999999999 109.478 173.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.652 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 9.3 m-85 -89.96 28.31 1.4 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.71 -1.132 . . . . 0.65000000000000002 110.1 177.046 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -117.47 -40.26 3.08 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.036 -1.098 . . . . 0.76000000000000001 108.036 174.24 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -65.58 -29.98 70.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.128 -0.942 . . . . 2.27 109.117 166.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -113.29 62.69 0.64 Allowed 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 114.943 -1.026 . . . . 1.2 110.057 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.652 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 31.3 t70 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.243 -0.884 . . . . 2.7200000000000002 110.428 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 112.144 -0.383 . . . . 19.890000000000001 112.144 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 32.5 m -121.56 151.05 56.24 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 109.942 -0.392 . . . . 18.329999999999998 109.942 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -77.23 47.53 2.27 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.86 2.373 . . . . 17.390000000000001 112.29 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -91.55 66.8 2.28 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 115.662 -0.699 . . . . 16.359999999999999 112.375 -177.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -150.82 130.09 6.46 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-O 120.783 0.325 . . . . 16.0 110.267 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -81.41 -11.25 11.92 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.675 2.25 . . . . 13.15 111.549 177.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 525' ' ' ASN . . . . . 0.45 ' O ' ' HB2' ' B' ' 528' ' ' LEU . 88.5 m-20 -86.4 67.91 10.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.446 -0.797 . . . . 12.359999999999999 110.544 -178.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -73.65 -5.93 70.09 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.96 -0.638 . . . . 9.6300000000000008 112.102 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.43 ' CD2' ' H ' ' B' ' 527' ' ' LEU . 0.9 OUTLIER -103.65 14.58 30.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.068 0.461 . . . . 8.3399999999999999 110.455 178.973 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 528' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' B' ' 525' ' ' ASN . 0.5 OUTLIER -79.37 47.64 0.83 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.905 -0.589 . . . . 10.41 110.62 -175.496 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 26.9 t 178.75 -58.59 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.098 -0.705 . . . . 7.6200000000000001 109.098 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 68.06 79.52 0.25 Allowed Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.795 -0.717 . . . . 5.1900000000000004 111.651 178.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -106.19 17.17 23.89 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.924 0.869 . . . . 5.5 108.856 -173.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -82.88 -10.04 59.02 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 114.153 -1.385 . . . . 5.6799999999999997 109.774 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -112.78 -31.62 6.67 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 113.089 -1.869 . . . . 3.2200000000000002 109.566 176.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -68.98 -17.32 63.92 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.444 -0.798 . . . . 4.2699999999999996 110.845 178.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 5.3 p -64.49 -24.56 67.65 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.069 -0.514 . . . . 1.25 111.032 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 15.2 m -71.22 -35.86 71.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.993 -0.549 . . . . 2.0800000000000001 110.661 177.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 23.0 mm -87.12 -31.62 6.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.052 -0.522 . . . . 1.29 110.359 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 538' ' ' ALA . . . . . 0.495 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -72.28 -1.07 13.93 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.653 0.739 . . . . 0.76000000000000001 110.656 178.458 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.531 ' HB2' HH22 ' A' ' 61' ' ' ARG . 30.6 t70 -74.77 -38.63 62.13 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.864 -1.062 . . . . 1.23 109.239 172.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 87.3 mtp -72.86 -23.56 60.76 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.831 -1.077 . . . . 2.29 110.069 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 541' ' ' ASP . . . . . 0.538 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 0.2 OUTLIER -65.16 -46.91 78.93 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.431 -0.804 . . . . 1.1799999999999999 110.238 174.381 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 542' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -40.98 86.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.523 -0.762 . . . . 0.56000000000000005 112.081 -172.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -26.48 66.95 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.041 0.448 . . . . 1.5800000000000001 111.281 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 544' ' ' ALA . . . . . 0.445 ' O ' ' HG3' ' B' ' 548' ' ' GLN . . . -85.49 -35.62 21.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.064 -0.516 . . . . 0.83999999999999997 110.307 177.081 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 96.3 mt -62.5 -44.09 97.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.926 -0.579 . . . . 1.0800000000000001 111.785 -179.228 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 20.6 mt -71.6 -22.88 61.66 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.548 0.69 . . . . 0.96999999999999997 110.195 -179.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 32.9 m -90.67 12.62 18.45 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.027 -0.988 . . . . 1.4199999999999999 111.281 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 548' ' ' GLN . . . . . 0.446 ' OE1' HD23 ' B' ' 545' ' ' LEU . 20.6 mt-30 -85.92 56.36 3.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.275 0.559 . . . . 2.6699999999999999 112.002 -178.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 549' ' ' ILE . . . . . 0.485 HD13 ' H ' ' B' ' 549' ' ' ILE . 0.2 OUTLIER -118.19 22.38 5.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.503 0.668 . . . . 5.2300000000000004 109.421 171.976 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.4 m -82.78 73.6 9.8 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.27 -0.877 . . . . 6.4000000000000004 110.463 -178.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 8.2 t . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.604 -0.712 . . . . 7.5899999999999999 109.19 179.831 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.551 ' HA ' ' OD1' ' A' ' 99' ' ' ASN . 1.2 Cg_endo . . . . . 0 N--CA 1.477 0.539 0 N-CA-C 110.718 -0.532 . . . . 1.8899999999999999 110.718 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.9 p -76.58 -22.11 54.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.185 -0.461 . . . . 2.0499999999999998 111.477 -176.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.558 ' CD2' HG21 ' A' ' 103' ' ' THR . 73.7 m80 64.12 -0.1 0.9 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.741 -0.663 . . . . 0.75 112.033 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.9 p -157.25 155.7 31.24 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 119.943 -0.703 . . . . 1.0900000000000001 112.318 -174.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.516 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -173.76 -162.17 25.14 Favored Glycine 0 N--CA 1.439 -1.124 0 CA-C-N 114.627 -1.169 . . . . 0.16 110.438 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -101.39 136.02 41.93 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 117.345 0.573 . . . . 0.16 110.162 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.5 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -147.45 141.15 25.63 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.988 0.423 . . . . 0.11 111.876 -176.028 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.479 HG12 ' HA ' ' A' ' 13' ' ' SER . 88.0 mt -105.58 122.26 58.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.147 -0.479 . . . . 0.33000000000000002 109.937 175.411 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -127.79 131.2 49.62 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.723 -0.843 . . . . 0.35999999999999999 108.723 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 60.28 29.62 19.16 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.909 0.484 . . . . 0.80000000000000004 110.562 -177.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm 65.72 5.78 3.54 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.921 0.711 . . . . 2.1099999999999999 112.921 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 p -98.49 119.91 47.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.476 -0.935 . . . . 0.22 108.476 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.479 ' HA ' HG12 ' A' ' 8' ' ' ILE . 52.5 p -74.34 144.71 44.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.158 -0.474 . . . . 1.0700000000000001 110.904 -175.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.422 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.81 -159.57 10.26 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.258 -0.972 . . . . 0.11 113.286 -178.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 19.9 mm -125.93 134.73 65.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 109.107 -0.701 . . . . 0.13 109.107 -178.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.554 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.22 135.7 37.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 110.129 -0.323 . . . . 0.13 110.129 -176.572 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.59 129.03 30.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.985 0.421 . . . . 0.10000000000000001 111.413 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.546 HD12 ' HA ' ' A' ' 3' ' ' HIS . 61.9 mt -85.91 135.37 25.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 109.763 -0.458 . . . . 0.27000000000000002 109.763 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -108.67 103.28 12.35 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.096 -0.502 . . . . 1.24 111.182 -173.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 28.2 mt-10 -116.79 170.75 8.36 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.46 -0.941 . . . . 1.2 108.46 174.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.456 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.8 t70 81.07 -5.97 1.63 Allowed 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 122.428 1.109 . . . . 0.57999999999999996 109.361 -176.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 23' ' ' SER . 32.7 m -103.33 -174.17 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 CA-C-N 113.753 -1.567 . . . . 0.25 109.943 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.662 ' O ' HG23 ' A' ' 22' ' ' VAL . 57.9 m -73.14 168.67 22.75 Favored Pre-proline 0 C--N 1.313 -1.001 0 N-CA-C 105.423 -2.066 . . . . 1.1299999999999999 105.423 173.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -41.31 128.13 3.16 Favored 'Trans proline' 0 C--N 1.355 0.885 0 CA-C-N 121.296 1.499 . . . . 0.16 112.642 -143.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.488 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -51.44 141.7 15.14 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 113.993 -1.458 . . . . 0.10000000000000001 112.563 -165.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.65 168.79 12.67 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 114.228 -1.351 . . . . 0.32000000000000001 111.922 -170.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -116.53 107.3 14.57 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.398 -1.334 . . . . 0.089999999999999997 107.398 172.173 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.6 m -104.49 106.7 17.3 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 120.878 0.371 . . . . 0.17000000000000001 110.894 -175.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.7 t90 -85.12 132.34 34.32 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.842 -0.799 . . . . 0.14000000000000001 108.842 172.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HG2' HG23 ' A' ' 37' ' ' VAL . 62.1 mtt180 -127.29 156.97 41.09 Favored 'General case' 0 C--N 1.31 -1.122 0 N-CA-C 108.893 -0.781 . . . . 1.9099999999999999 108.893 174.515 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -68.76 176.04 3.25 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.385 -0.598 . . . . 0.59999999999999998 109.385 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.422 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 9.3 p -60.13 -40.79 91.02 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.162 -0.615 . . . . 0.26000000000000001 110.421 178.304 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -76.73 -31.33 57.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.85 0.833 . . . . 2.1200000000000001 109.157 170.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.458 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 89.63 15.27 58.55 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 114.458 -1.247 . . . . 0.23000000000000001 111.813 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -64.36 -53.37 49.7 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.288 -0.634 . . . . 1.73 109.288 174.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.0 tttt -76.76 139.28 40.36 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.328 -0.851 . . . . 1.3 108.878 174.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.5 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.4 p -149.43 138.81 15.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.927 0.394 . . . . 0.17000000000000001 111.142 -178.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -144.18 126.21 15.45 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.751 -0.463 . . . . 0.40999999999999998 109.751 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 30.0 m -114.7 133.22 56.05 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.396 0.517 . . . . 0.14999999999999999 112.396 -173.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -101.74 130.05 52.0 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.592 0 N-CA-C 108.125 -1.065 . . . . 0.12 108.125 168.482 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.404 ' O ' HG12 ' A' ' 45' ' ' ILE . 63.3 t -93.72 121.93 44.77 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 O-C-N 121.194 -0.941 . . . . 0.11 108.801 173.017 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.594 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.35 -18.45 63.8 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.136 0.791 . . . . 0.080000000000000002 113.136 -169.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.6 p -69.55 -15.47 63.23 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.922 -0.711 . . . . 0.87 109.562 174.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 p -109.84 12.2 24.03 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.464 -0.789 . . . . 0.14999999999999999 110.013 -178.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.552 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.9 mm -111.54 138.91 38.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.991 -0.549 . . . . 0.12 109.659 178.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -100.1 -46.66 5.25 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.824 -0.625 . . . . 0.52000000000000002 110.563 -177.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.493 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 18.1 mtmt -140.3 174.73 10.22 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.135 0.493 . . . . 1.4099999999999999 111.442 -176.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.616 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -152.73 136.07 15.84 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.748 -0.834 . . . . 0.72999999999999998 108.748 -179.35 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.557 ' HG2' HD11 ' A' ' 63' ' ' ILE . 44.7 mm-40 -129.81 122.53 28.94 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 122.282 -0.261 . . . . 1.9399999999999999 110.463 -175.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.455 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -116.09 140.97 48.74 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 122.052 -0.405 . . . . 0.22 111.279 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 66.6 p -66.97 119.3 63.03 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-N 116.099 -0.5 . . . . 0.26000000000000001 110.146 -177.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.459 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 26.0 Cg_exo -54.25 159.91 7.28 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 122.721 2.28 . . . . 0.38 111.556 178.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.89 -15.69 63.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.195 -0.457 . . . . 0.66000000000000003 110.573 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -86.14 -16.82 36.71 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 1.5 110.595 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.459 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 47.4 m -76.79 140.7 40.81 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.845 -0.616 . . . . 0.84999999999999998 111.019 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -66.56 -18.68 65.5 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.404 -0.817 . . . . 1.77 110.7 176.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.575 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 11.2 mmmm -87.05 151.14 23.5 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.743 -1.117 . . . . 1.6299999999999999 111.031 -175.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -124.93 96.57 4.92 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 108.121 -1.066 . . . . 1.1100000000000001 108.121 169.139 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.575 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.23 155.96 34.77 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.458 0.647 . . . . 0.22 111.899 -174.499 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.606 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -134.36 119.25 18.4 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.698 -1.137 . . . . 0.10000000000000001 108.329 175.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.727 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 3.5 mtp180 -102.42 142.78 33.08 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.249 0.547 . . . . 2.9900000000000002 111.311 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.942 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -121.53 107.81 12.87 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.036 -0.984 . . . . 0.13 109.012 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.609 HG13 ' HD2' ' A' ' 86' ' ' ARG . 1.7 mp -90.81 103.67 14.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.773 -0.455 . . . . 0.28999999999999998 109.773 -172.068 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -67.54 151.89 52.39 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 121.394 -0.432 . . . . 0.54000000000000004 112.885 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.498 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 83.8 mttt -70.54 159.03 35.07 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 122.655 0.382 . . . . 0.55000000000000004 111.182 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -106.35 109.43 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 116.293 -0.412 . . . . 1.73 110.953 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.577 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.3 m-20 -93.62 79.11 4.29 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.993 -1.114 . . . . 3.23 107.993 169.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.68 -1.79 4.18 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.31 0.485 . . . . 2.3900000000000001 112.31 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.2 p -69.21 -11.26 60.65 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.35 0.595 . . . . 2.96 109.861 168.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -84.69 26.41 0.82 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.399 -0.819 . . . . 2.4900000000000002 111.382 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.7 mtmt -47.08 113.75 0.73 Allowed 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.432 0.634 . . . . 3.3999999999999999 109.332 -174.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.47 ' HB3' HG23 ' A' ' 80' ' ' VAL . 72.6 ttt180 -96.85 168.61 10.39 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.692 -1.14 . . . . 3.7999999999999998 109.069 -167.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 63.9 mttp -133.59 141.47 47.69 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 118.104 0.411 . . . . 4.29 110.185 174.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -82.11 -168.38 1.93 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.902 -0.59 . . . . 4.4100000000000001 110.695 -177.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -56.84 -31.11 64.45 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.799 0.296 . . . . 5.3399999999999999 111.799 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.448 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 10.6 mt-10 -86.86 -34.68 19.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.1 0.476 . . . . 5.3799999999999999 110.444 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.94 18.36 5.15 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.478 -0.868 . . . . 4.3700000000000001 112.049 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.551 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 30.8 m-80 -75.39 134.8 40.86 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.993 -0.744 . . . . 4.5099999999999998 108.993 177.557 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -69.02 92.68 0.53 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.982 0.42 . . . . 4.2800000000000002 110.235 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.47 HG23 ' HB3' ' A' ' 72' ' ' ARG . 19.0 m -97.22 99.58 9.16 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-O 121.677 0.751 . . . . 3.1000000000000001 109.574 176.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 1.5 p -85.4 107.38 12.0 Favored Pre-proline 0 C--N 1.317 -0.844 0 N-CA-C 109.354 -0.61 . . . . 2.5 109.354 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -63.8 151.6 84.43 Favored 'Trans proline' 0 C--O 1.234 0.301 0 C-N-CA 123.48 2.786 . . . . 1.8700000000000001 113.943 -170.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.546 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 27.3 mtmm -87.26 172.85 7.36 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 113.991 -1.459 . . . . 2.7400000000000002 108.684 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.546 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 22.9 Cg_exo -53.39 143.98 52.0 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 121.194 1.263 . . . . 0.83999999999999997 111.281 176.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -92.79 113.35 25.6 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 116.201 -0.454 . . . . 1.5700000000000001 109.777 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.609 ' HD2' HG13 ' A' ' 63' ' ' ILE . 0.7 OUTLIER -96.37 121.7 38.45 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 109.537 -0.542 . . . . 2.52 109.537 -176.048 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.557 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 62.5 m80 -96.29 148.08 23.12 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 107.541 -1.281 . . . . 0.71999999999999997 107.541 176.104 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.727 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 22.9 ttm -140.97 132.35 26.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 119.135 0.88 . . . . 0.27000000000000002 111.265 173.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.5 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.6 m-85 -122.18 128.74 51.58 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.339 -0.846 . . . . 0.27000000000000002 109.588 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.477 ' O ' ' HA ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -81.65 150.57 28.01 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.943 -0.391 . . . . 1.26 109.943 177.251 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.427 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.1 m-85 -130.13 175.73 8.67 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.965 0.412 . . . . 0.32000000000000001 111.55 -173.525 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -122.57 -9.53 8.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.715 -0.675 . . . . 2.3799999999999999 110.494 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.51 ' HB2' HG23 ' A' ' 96' ' ' VAL . 52.6 m-80 -146.16 136.96 24.31 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.237 -0.438 . . . . 1.1000000000000001 110.087 -179.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.464 ' HD3' ' HE1' ' A' ' 58' ' ' MET . 1.2 mpp_? -70.5 -35.09 73.03 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.905 -0.589 . . . . 3.0899999999999999 111.544 -178.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.448 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 19.5 m -61.63 -36.34 80.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.801 0.334 . . . . 0.34999999999999998 110.578 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.615 ' O ' HG12 ' A' ' 100' ' ' ILE . 17.5 t -64.71 -58.2 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 116.203 -0.453 . . . . 0.23000000000000001 110.499 178.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.606 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.0 ptp -57.59 -39.1 76.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.17000000000000001 110.916 -177.257 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.407 ' N ' ' HG3' ' A' ' 97' ' ' MET . 19.5 t70 -65.66 -42.14 91.7 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.641 -0.424 . . . . 0.34000000000000002 110.208 177.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.551 ' OD1' ' HA ' ' A' ' 1' ' ' PRO . 1.6 t-20 -68.83 -43.97 74.42 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 123.27 0.356 . . . . 1.3600000000000001 111.351 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 96' ' ' VAL . 31.4 mm -61.8 -56.58 16.81 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 N-CA-C 108.674 -0.862 . . . . 0.12 108.674 177.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.803 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.8 ttpt -50.81 -48.6 59.67 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.9 0.75 . . . . 0.79000000000000004 109.864 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.685 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 44.2 ttp -49.35 -54.82 15.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.387 -0.824 . . . . 0.28000000000000003 111.321 177.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.696 ' O ' HG13 ' A' ' 107' ' ' ILE . 30.0 m -61.92 -51.96 66.0 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.322 -0.399 . . . . 0.17999999999999999 110.592 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.942 HD13 HD21 ' A' ' 62' ' ' LEU . 29.2 mt -46.48 -54.7 8.74 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.835 -0.62 . . . . 0.089999999999999997 110.17 174.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.558 ' CG ' HD13 ' A' ' 48' ' ' LEU . 90.8 mt-30 -52.17 -43.87 64.34 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.747 -1.115 . . . . 1.2 112.262 176.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.685 ' HG3' ' O ' ' A' ' 102' ' ' MET . 37.6 mt-30 -64.3 -40.65 96.37 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.952 0.882 . . . . 2.3700000000000001 108.966 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.696 HG13 ' O ' ' A' ' 103' ' ' THR . 7.8 mt -68.88 -42.22 82.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 114.29 -1.323 . . . . 0.14999999999999999 111.163 -178.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.616 HD12 HD11 ' A' ' 48' ' ' LEU . 7.2 mt -66.91 -37.64 79.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.413 -0.358 . . . . 0.19 111.471 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.4 t -59.58 -28.85 67.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.699 0.285 . . . . 1.1399999999999999 110.587 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -59.41 -53.6 56.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.281 -0.637 . . . . 1.6399999999999999 109.281 173.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.558 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 11.5 m-85 -86.99 32.97 0.66 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.2 -0.909 . . . . 0.65000000000000002 110.265 176.419 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? -122.19 -44.62 2.27 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.384 -1.339 . . . . 0.76000000000000001 107.384 174.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -70.4 -37.34 74.48 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.743 -1.117 . . . . 2.27 109.392 168.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -106.41 61.01 0.64 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.361 -0.836 . . . . 1.2 109.761 175.659 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.558 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 35.2 t70 . . . . . 0 C--O 1.249 1.038 0 CA-C-N 115.268 -0.878 . . . . 2.7200000000000002 110.313 -178.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 N-CA-C 111.685 -0.566 . . . . 19.890000000000001 111.685 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 520' ' ' SER . . . . . 0.476 ' HB3' ' HB2' ' B' ' 523' ' ' TYR . 49.0 m -131.25 80.73 67.63 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-O 120.721 0.296 . . . . 18.329999999999998 110.458 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.8 85.14 1.36 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.789 2.326 . . . . 17.390000000000001 112.704 -178.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 88.75 40.38 6.31 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.774 -0.727 . . . . 16.359999999999999 112.653 177.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 523' ' ' TYR . . . . . 0.476 ' HB2' ' HB3' ' B' ' 520' ' ' SER . 97.4 m-85 -126.67 79.92 70.98 Favored Pre-proline 0 C--N 1.326 -0.423 0 N-CA-C 110.27 -0.271 . . . . 16.0 110.27 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -86.86 15.25 2.23 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.555 2.17 . . . . 13.15 113.032 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 525' ' ' ASN . . . . . 0.402 HD22 ' HA ' ' B' ' 525' ' ' ASN . 2.2 t-20 53.42 40.67 31.69 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.641 -0.709 . . . . 12.359999999999999 110.326 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -87.34 -81.03 1.21 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.845 -0.693 . . . . 9.6300000000000008 112.973 -175.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.95 24.6 2.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.984 0.421 . . . . 8.3399999999999999 111.168 -177.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 64.4 mt -73.07 8.74 1.45 Allowed 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 112.993 0.738 . . . . 10.41 112.993 -172.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 6.8 m -143.32 -47.91 0.3 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.033 0.444 . . . . 7.6200000000000001 111.581 -178.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 113.22 -2.94 25.32 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 110.445 -1.062 . . . . 5.1900000000000004 110.445 -171.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -142.25 40.39 1.61 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.26 -0.97 . . . . 5.5 108.751 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 532' ' ' GLU . . . . . 0.42 ' HA ' ' HB3' ' B' ' 536' ' ' SER . 22.6 mm-40 -95.9 -2.47 47.2 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.482 -0.781 . . . . 5.6799999999999997 112.438 -171.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -96.76 -62.63 1.23 Allowed 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.761 -0.654 . . . . 3.2200000000000002 112.66 -171.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -114.76 -40.57 3.53 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.191 0.52 . . . . 4.2699999999999996 111.073 -175.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 535' ' ' SER . . . . . 0.522 ' HB2' HH22 ' A' ' 61' ' ' ARG . 2.9 p -75.47 -3.11 32.09 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.479 -0.782 . . . . 1.25 110.415 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 536' ' ' SER . . . . . 0.42 ' HB3' ' HA ' ' B' ' 532' ' ' GLU . 56.1 p -77.44 -56.29 4.67 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.328 -0.851 . . . . 2.0800000000000001 109.69 172.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 44.9 mm -70.3 -38.71 75.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.356 -0.838 . . . . 1.29 110.267 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -76.29 3.03 11.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.886 -0.597 . . . . 0.76000000000000001 111.168 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.493 ' HB2' ' O ' ' B' ' 535' ' ' SER . 27.4 t70 -89.42 -43.51 10.82 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.901 -0.777 . . . . 1.23 108.901 172.063 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 52.7 mtm -65.38 -30.54 71.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.301 -0.863 . . . . 2.29 109.467 172.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -53.51 -40.65 65.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.827 -1.079 . . . . 1.1799999999999999 110.529 171.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.438 ' HZ ' ' C ' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -82.97 -42.5 17.51 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.747 -1.115 . . . . 0.56000000000000005 111.272 -173.411 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 14.8 t -56.84 -36.32 69.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.658 -0.701 . . . . 1.5800000000000001 111.143 -175.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -71.78 -28.21 63.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.316 -0.402 . . . . 0.83999999999999997 111.502 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 87.0 mt -70.38 -39.89 74.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.246 -0.433 . . . . 1.0800000000000001 111.924 -176.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 5.1 mt -84.71 -7.62 59.15 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.33 0.586 . . . . 0.96999999999999997 109.91 -178.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 29.7 t -110.05 21.94 16.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.032 -0.985 . . . . 1.4199999999999999 110.487 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 76.6 mm-40 -68.17 -54.4 18.18 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.6 0.714 . . . . 2.6699999999999999 110.689 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 31.6 mt -85.24 74.17 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.148 0 CA-C-N 114.801 -1.091 . . . . 5.2300000000000004 109.591 177.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 5.7 p -80.95 72.8 7.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.781 -0.645 . . . . 6.4000000000000004 110.888 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 51.0 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.462 -0.78 . . . . 7.5899999999999999 110.218 178.681 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo . . . . . 0 N--CA 1.479 0.663 0 N-CA-C 110.66 -0.554 . . . . 1.8899999999999999 110.66 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.5 p -65.19 -27.9 69.02 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.034 0.383 . . . . 2.0499999999999998 112.034 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.561 ' HA ' HD12 ' A' ' 18' ' ' ILE . 74.5 m80 70.11 -9.23 0.75 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.502 0.721 . . . . 0.75 112.015 -178.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.1 p -154.27 163.19 40.52 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 119.817 -0.753 . . . . 1.0900000000000001 112.293 -176.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.529 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 177.0 -158.0 23.41 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 110.424 -1.07 . . . . 0.16 110.424 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.422 ' HA ' HD13 ' A' ' 15' ' ' ILE . . . -102.54 135.07 44.83 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 117.386 0.593 . . . . 0.16 110.472 179.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.522 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -147.26 142.74 27.53 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.274 -0.421 . . . . 0.11 111.247 -177.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.782 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 62.3 mt -101.72 126.46 55.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.993 -0.373 . . . . 0.33000000000000002 109.993 175.041 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.442 ' O ' HG13 ' A' ' 12' ' ' VAL . 21.2 t80 -129.51 129.92 45.14 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.581 -0.896 . . . . 0.35999999999999999 108.581 177.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 62.45 29.12 17.1 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 123.386 0.429 . . . . 0.80000000000000004 110.5 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm 68.52 -0.12 2.38 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.982 0.734 . . . . 2.1099999999999999 112.982 178.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.442 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.7 OUTLIER -92.86 116.86 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 108.228 -1.027 . . . . 0.22 108.228 166.915 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.5 p -73.24 142.27 47.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.29 -0.414 . . . . 1.0700000000000001 110.42 -176.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.493 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -158.42 -158.17 8.87 Favored Glycine 0 N--CA 1.438 -1.21 0 C-N-CA 119.835 -1.174 . . . . 0.11 113.732 -176.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.422 HD13 ' HA ' ' A' ' 6' ' ' ALA . 18.8 mm -125.98 132.02 71.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.972 -0.614 . . . . 0.13 109.451 -177.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.543 HD11 HD11 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.25 136.38 34.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 110.014 -0.365 . . . . 0.13 110.014 -177.181 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.09 129.84 30.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.9 0.381 . . . . 0.10000000000000001 111.318 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 3' ' ' HIS . 65.4 mt -86.25 132.64 31.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 110.011 -0.366 . . . . 0.27000000000000002 110.011 177.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -105.29 101.88 11.4 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.128 -0.487 . . . . 1.24 110.608 -175.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -116.5 167.95 10.6 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.374 -0.602 . . . . 1.2 109.374 175.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 76.8 -2.56 2.66 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 122.165 0.984 . . . . 0.57999999999999996 109.964 -175.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 23' ' ' SER . 30.4 m -102.64 -174.52 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.022 0 CA-C-N 114.051 -1.431 . . . . 0.25 109.324 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.614 ' O ' HG23 ' A' ' 22' ' ' VAL . 75.6 m -72.4 167.14 35.36 Favored Pre-proline 0 C--N 1.314 -0.942 0 N-CA-C 105.198 -2.149 . . . . 1.1299999999999999 105.198 175.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.429 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 94.8 Cg_exo -41.9 127.75 3.78 Favored 'Trans proline' 0 C--N 1.354 0.85 0 CA-C-N 121.213 1.469 . . . . 0.16 112.136 -141.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.481 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.07 139.32 23.32 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 113.97 -1.468 . . . . 0.10000000000000001 112.17 -163.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 24' ' ' PRO . 0.7 OUTLIER -125.48 168.44 13.63 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 114.225 -1.352 . . . . 0.32000000000000001 111.823 -169.847 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.765 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -116.83 105.42 12.35 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 107.365 -1.346 . . . . 0.089999999999999997 107.365 174.017 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.6 m -101.85 107.09 18.17 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 121.061 0.458 . . . . 0.17000000000000001 111.122 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.9 t90 -85.21 132.04 34.34 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.044 -0.725 . . . . 0.14000000000000001 109.044 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.723 ' HG2' HG23 ' A' ' 37' ' ' VAL . 66.2 mtp180 -123.06 163.22 20.92 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 109.039 -0.726 . . . . 1.9099999999999999 109.039 172.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 p -71.26 177.52 3.83 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 108.95 -0.759 . . . . 0.59999999999999998 108.95 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.493 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.0 OUTLIER -58.34 -36.68 73.81 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.316 -0.553 . . . . 0.26000000000000001 111.017 179.684 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -88.98 -31.23 18.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.608 0.718 . . . . 2.1200000000000001 109.91 171.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.62 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 96.76 16.25 36.96 Favored Glycine 0 N--CA 1.447 -0.613 0 CA-C-N 114.978 -1.01 . . . . 0.23000000000000001 112.1 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -62.18 -43.47 98.75 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.084 -0.71 . . . . 1.73 109.084 172.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.1 tttt -89.9 141.73 28.37 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.76 -0.83 . . . . 1.3 108.76 174.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.723 HG23 ' HG2' ' A' ' 30' ' ' ARG . 7.9 p -149.4 136.46 13.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.942 0.401 . . . . 0.17000000000000001 111.272 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -144.28 127.26 16.44 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.634 -0.506 . . . . 0.40999999999999998 109.634 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 36.7 m -117.11 132.83 56.58 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.812 0.671 . . . . 0.14999999999999999 112.812 -173.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.765 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -99.27 130.05 48.81 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.611 0 N-CA-C 108.017 -1.105 . . . . 0.12 108.017 168.693 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.421 ' O ' HG12 ' A' ' 45' ' ' ILE . 57.8 t -93.16 122.31 44.55 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 O-C-N 121.071 -1.018 . . . . 0.11 109.099 173.28 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.603 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.38 -19.38 63.83 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.736 0.643 . . . . 0.080000000000000002 112.736 -170.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.422 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 13.7 p -69.8 -12.29 61.51 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.366 0.603 . . . . 0.87 109.635 174.812 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.4 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 4.7 p -112.62 13.8 20.02 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.328 -0.851 . . . . 0.14999999999999999 109.879 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.554 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.5 mm -114.97 144.77 21.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.303 -0.629 . . . . 0.12 109.303 177.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -114.85 -37.39 4.2 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.691 0.281 . . . . 0.52000000000000002 111.168 -177.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.45 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 9.8 mtmm -139.26 168.8 19.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.732 0.301 . . . . 1.4099999999999999 111.43 -179.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.815 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -152.04 137.97 18.1 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 109.408 -0.59 . . . . 0.72999999999999998 109.408 -179.521 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 9.5 mm-40 -134.53 115.21 13.64 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 122.175 -0.328 . . . . 1.9399999999999999 111.505 -171.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.567 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -114.44 144.41 43.35 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.765 -0.584 . . . . 0.22 112.195 -177.567 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.449 ' N ' ' HZ ' ' B' ' 542' ' ' PHE . 69.0 p -68.55 119.66 70.05 Favored Pre-proline 0 C--O 1.233 0.237 0 CA-C-N 115.418 -0.81 . . . . 0.26000000000000001 110.784 -176.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.84 155.16 14.96 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.798 2.332 . . . . 0.38 111.723 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.6 -17.09 62.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.66000000000000003 112.402 -174.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.5 t -99.81 -7.79 24.99 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.806 0.336 . . . . 1.5 110.766 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.2 m -71.87 138.5 48.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.218 0.532 . . . . 0.84999999999999998 111.482 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -55.78 -23.66 31.16 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.038 -0.983 . . . . 1.77 111.084 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -88.67 148.55 23.96 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.874 -1.057 . . . . 1.6299999999999999 111.875 -174.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.619 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -118.87 95.46 4.84 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.12 -1.067 . . . . 1.1100000000000001 108.12 166.609 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.619 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -157.5 158.56 35.95 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.524 0.678 . . . . 0.22 112.505 -173.793 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -140.67 119.89 12.94 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.651 -1.158 . . . . 0.10000000000000001 108.318 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.706 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.2 mtp180 -102.53 147.53 26.65 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.426 0.631 . . . . 2.9900000000000002 112.014 -178.266 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.922 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -125.32 105.3 9.0 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.431 -1.259 . . . . 0.13 108.987 178.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.528 HD12 ' N ' ' A' ' 63' ' ' ILE . 3.1 mp -88.91 106.15 16.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 110.137 -0.32 . . . . 0.28999999999999998 110.137 -174.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.76 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -66.52 166.2 39.05 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.936 -0.575 . . . . 0.54000000000000004 112.925 -178.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.528 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 83.0 mttt -84.33 124.34 31.16 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.861 0.363 . . . . 0.55000000000000004 111.362 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.651 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 2.2 t -121.44 138.84 50.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 115.905 -0.589 . . . . 1.73 110.39 172.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.562 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 14.0 m-20 -83.21 80.42 9.07 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.433 -0.803 . . . . 3.23 108.995 177.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -69.25 -2.6 11.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.957 0.408 . . . . 2.3900000000000001 111.42 -174.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.9 p -65.12 -17.33 64.38 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.524 -0.547 . . . . 2.96 109.524 169.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.562 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -79.42 132.53 36.41 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.187 0.994 . . . . 2.4900000000000002 110.528 176.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.4 mmtm -101.4 116.85 33.73 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 114.646 -1.161 . . . . 3.3999999999999999 109.246 167.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 41.0 ttm180 -99.33 157.57 16.31 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.463 -0.94 . . . . 3.7999999999999998 108.463 176.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 50.9 mttp -128.25 147.19 50.58 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.811 -0.441 . . . . 4.29 109.811 174.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.436 ' HB2' ' HG3' ' B' ' 524' ' ' PRO . 0.6 OUTLIER -90.29 -172.86 3.61 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.554 -0.748 . . . . 4.4100000000000001 110.483 -175.868 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -58.55 -31.42 67.95 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.093 0.405 . . . . 5.3399999999999999 112.093 -178.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.591 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 30.8 mt-10 -85.49 -22.69 28.1 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.907 -0.317 . . . . 5.3799999999999999 110.96 -178.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 105.7 19.11 10.65 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.624 -0.798 . . . . 4.3700000000000001 112.38 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.591 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 37.9 m-80 -77.88 140.61 39.34 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.383 -0.599 . . . . 4.5099999999999998 109.383 177.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -74.23 95.67 2.66 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.469 -0.567 . . . . 4.2800000000000002 109.469 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.3 m -107.88 98.79 7.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 109.003 -0.739 . . . . 3.1000000000000001 109.003 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.426 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -89.0 114.55 60.62 Favored Pre-proline 0 C--N 1.316 -0.866 0 CA-C-N 115.892 -0.595 . . . . 2.5 110.375 -175.823 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 25.5 Cg_exo -67.0 135.97 39.5 Favored 'Trans proline' 0 CA--C 1.51 -0.721 0 C-N-CA 123.036 2.491 . . . . 1.8700000000000001 113.716 -174.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.522 ' HG3' ' OH ' ' B' ' 523' ' ' TYR . 37.1 mtmm -95.43 162.46 24.47 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 114.18 -1.373 . . . . 2.7400000000000002 109.309 172.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.76 ' HB3' ' O ' ' A' ' 64' ' ' GLY . 50.3 Cg_exo -50.54 152.47 8.95 Favored 'Trans proline' 0 C--O 1.233 0.234 0 C-N-CA 122.949 2.433 . . . . 0.83999999999999997 113.617 179.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -91.58 124.44 35.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.181 -0.918 . . . . 1.5700000000000001 109.615 -178.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.495 ' HG2' HG13 ' A' ' 63' ' ' ILE . 78.8 mtt180 -104.54 126.39 51.58 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 121.727 0.775 . . . . 2.52 111.079 -172.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 67.1 m80 -95.25 146.3 24.44 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.505 -1.295 . . . . 0.71999999999999997 107.505 177.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.706 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 19.5 ttm -140.74 130.55 24.39 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 118.914 0.779 . . . . 0.27000000000000002 111.309 175.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.551 ' O ' ' HA ' ' A' ' 59' ' ' MET . 11.6 m-85 -116.61 138.05 51.72 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.371 -0.831 . . . . 0.27000000000000002 109.614 178.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.782 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -81.06 159.04 24.87 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 109.078 -0.712 . . . . 1.26 109.078 174.381 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 18.1 m-85 -138.34 175.47 9.55 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.91 0.386 . . . . 0.32000000000000001 111.478 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -130.63 -0.75 4.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.828 -0.624 . . . . 2.3799999999999999 110.115 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.505 ' HB2' HG23 ' A' ' 96' ' ' VAL . 62.2 m-80 -147.1 133.55 19.69 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.176 -0.465 . . . . 1.1000000000000001 110.223 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.429 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 36.0 mmt180 -72.01 -39.2 69.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.632 -0.713 . . . . 3.0899999999999999 111.208 -178.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.4 m -60.84 -33.44 73.05 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.994 -0.548 . . . . 0.34999999999999998 110.696 -177.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.638 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.3 t -67.25 -61.44 1.69 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 CA-C-N 116.052 -0.522 . . . . 0.23000000000000001 110.247 176.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.581 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.3 ptp -54.69 -38.58 67.18 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.25 -0.432 . . . . 0.17000000000000001 111.234 -175.39 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 102' ' ' MET . 29.9 t70 -62.98 -47.72 81.93 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.333 -0.394 . . . . 0.34000000000000002 110.511 177.369 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -68.95 -39.01 79.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.992 -0.549 . . . . 1.3600000000000001 111.619 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.668 HG22 HD11 ' A' ' 104' ' ' LEU . 35.7 mm -63.36 -58.92 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 109.039 -0.726 . . . . 0.12 109.039 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.811 ' HA ' HD12 ' A' ' 104' ' ' LEU . 14.6 ttpp -51.25 -47.76 62.34 Favored 'General case' 0 CA--C 1.508 -0.64 0 O-C-N 123.795 0.684 . . . . 0.79000000000000004 109.818 177.661 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.69 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 37.8 ttp -51.19 -55.28 18.77 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.065 -0.971 . . . . 0.28000000000000003 110.943 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.735 ' O ' HG13 ' A' ' 107' ' ' ILE . 31.9 m -60.41 -51.74 68.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.284 -0.416 . . . . 0.17999999999999999 110.455 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.922 HD13 HD21 ' A' ' 62' ' ' LEU . 31.7 mt -47.38 -54.96 9.85 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.409 0.684 . . . . 0.089999999999999997 110.312 175.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.666 ' CG ' HD13 ' A' ' 48' ' ' LEU . 23.5 mt-30 -53.7 -39.1 64.9 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.502 -1.226 . . . . 1.2 112.565 178.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.69 ' HG3' ' O ' ' A' ' 102' ' ' MET . 17.0 mt-30 -67.2 -42.46 84.09 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.863 0.839 . . . . 2.3700000000000001 109.04 177.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.735 HG13 ' O ' ' A' ' 103' ' ' THR . 14.1 mt -64.8 -46.79 90.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.298 -1.319 . . . . 0.14999999999999999 110.997 -179.253 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.815 HD12 HD11 ' A' ' 48' ' ' LEU . 7.6 mt -61.95 -32.22 53.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.841 -0.618 . . . . 0.19 111.222 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.408 ' HA ' ' HB2' ' A' ' 112' ' ' LYS . 38.5 t -61.44 -31.51 71.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.488 -0.324 . . . . 1.1399999999999999 110.399 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -63.57 -40.19 96.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.375 0.607 . . . . 1.6399999999999999 109.387 175.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.422 ' CG ' ' HA ' ' A' ' 43' ' ' SER . 35.0 m-85 -97.7 18.28 15.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.445 -0.798 . . . . 0.65000000000000002 110.103 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.408 ' HB2' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER -103.09 -41.22 6.16 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 107.717 -1.216 . . . . 0.76000000000000001 107.717 175.655 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.39 -36.53 74.14 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.773 -1.103 . . . . 2.27 109.457 169.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -105.89 54.73 0.69 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.315 -0.857 . . . . 1.2 109.894 174.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.512 ' OD2' ' HE2' ' A' ' 65' ' ' LYS . 11.1 t70 . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.662 -0.685 . . . . 2.7200000000000002 110.028 -178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.671 0 N-CA-C 111.833 -0.507 . . . . 19.890000000000001 111.833 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 5.4 p -90.46 144.79 31.29 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 110.487 -0.19 . . . . 18.329999999999998 110.487 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -76.27 41.71 0.9 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.02 2.48 . . . . 17.390000000000001 112.233 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 84.61 5.31 86.84 Favored Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.782 -0.644 . . . . 16.359999999999999 112.491 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 523' ' ' TYR . . . . . 0.522 ' OH ' ' HG3' ' A' ' 83' ' ' LYS . 76.8 m-85 -140.96 134.78 14.92 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 120.822 0.344 . . . . 16.0 111.203 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 524' ' ' PRO . . . . . 0.436 ' HG3' ' HB2' ' A' ' 74' ' ' ASP . 92.8 Cg_endo -78.14 170.0 19.41 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.061 2.508 . . . . 13.15 111.992 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 58.9 t30 63.8 79.56 0.25 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.447 0.641 . . . . 12.359999999999999 110.18 -177.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -63.07 -33.96 88.67 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.455 -0.793 . . . . 9.6300000000000008 113.562 -173.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.838 HD13 ' H ' ' B' ' 527' ' ' LEU . 0.0 OUTLIER -79.49 8.95 5.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.274 0.537 . . . . 8.3399999999999999 112.423 -176.957 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 40.8 tp -75.71 -5.52 46.06 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 107.777 -1.194 . . . . 10.41 107.777 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 65.0 m -161.02 60.33 0.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 113.766 -1.561 . . . . 7.6200000000000001 107.727 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -48.21 -40.03 21.22 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 114.935 -1.03 . . . . 5.1900000000000004 114.511 -169.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -123.33 11.62 9.37 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.067 0.461 . . . . 5.5 110.096 178.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -110.19 -2.2 16.99 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.738 -0.665 . . . . 5.6799999999999997 111.882 -176.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.7 -33.64 31.07 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.005 -0.543 . . . . 3.2200000000000002 109.983 178.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -65.86 -39.74 91.02 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.633 0.73 . . . . 4.2699999999999996 110.131 176.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 3.7 p -73.17 -20.36 60.91 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.004 -0.998 . . . . 1.25 110.513 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 536' ' ' SER . . . . . 0.409 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 71.2 m -74.17 -35.23 63.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.345 -0.388 . . . . 2.0800000000000001 110.328 174.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 537' ' ' ILE . . . . . 0.477 HD13 ' HA ' ' B' ' 537' ' ' ILE . 9.8 mm -76.77 -31.42 19.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.015 0.436 . . . . 1.29 110.381 174.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -75.98 3.28 10.59 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.389 0.614 . . . . 0.76000000000000001 110.427 175.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.568 ' HB2' ' NH1' ' A' ' 61' ' ' ARG . 26.3 t70 -84.16 -31.88 24.92 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.295 -0.866 . . . . 1.23 109.461 174.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -60.92 -26.91 67.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.334 -0.848 . . . . 2.29 110.431 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -61.81 -37.68 85.32 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.955 -0.566 . . . . 1.1799999999999999 110.005 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.449 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -69.5 -35.04 75.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.46 -0.791 . . . . 0.56000000000000005 111.583 -175.91 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 23.0 t -58.16 -33.25 69.01 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.971 -0.559 . . . . 1.5800000000000001 110.556 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -78.36 -32.76 49.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.108 -0.496 . . . . 0.83999999999999997 110.857 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.56 ' O ' ' HG3' ' B' ' 548' ' ' GLN . 88.2 mt -76.39 -37.98 56.35 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.599 0.592 . . . . 1.0800000000000001 112.599 -175.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 546' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' A' ' 49' ' ' GLN . 20.3 mt -81.52 -11.2 59.27 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.53 0.681 . . . . 0.96999999999999997 109.978 -177.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 43.3 m -92.6 -56.12 3.13 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.955 -1.021 . . . . 1.4199999999999999 110.238 173.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 548' ' ' GLN . . . . . 0.56 ' HG3' ' O ' ' B' ' 545' ' ' LEU . 86.2 mt-30 51.89 54.33 11.08 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.227 0.537 . . . . 2.6699999999999999 110.992 -179.008 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 49.5 mm -115.5 -44.47 3.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.394 -0.821 . . . . 5.2300000000000004 109.773 178.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 32.5 t -113.69 24.11 12.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.634 -0.712 . . . . 6.4000000000000004 109.921 179.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 50.5 m . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.369 -0.824 . . . . 7.5899999999999999 109.784 178.866 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo . . . . . 0 N--CA 1.477 0.517 0 N-CA-C 110.567 -0.59 . . . . 1.8899999999999999 110.567 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.4 m -47.65 -60.17 2.75 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.914 1.079 . . . . 2.0499999999999998 113.914 -171.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 73.1 m80 65.53 -11.29 0.18 Allowed 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.159 0.583 . . . . 0.75 112.365 -173.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.2 p -156.91 166.2 34.02 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.519 0.563 . . . . 1.0900000000000001 112.519 -171.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.482 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 174.45 -166.67 38.68 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.595 -1.002 . . . . 0.16 110.595 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.3 134.33 36.9 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 117.798 0.799 . . . . 0.16 110.301 178.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.424 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -147.36 144.74 28.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.171 0.51 . . . . 0.11 111.628 -178.121 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.498 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 98.2 mt -102.79 119.42 51.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.848 -0.615 . . . . 0.33000000000000002 110.166 176.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.428 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.8 t80 -126.1 137.2 53.59 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 109.142 -0.688 . . . . 0.35999999999999999 109.142 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 62.07 22.95 13.48 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.522 0.514 . . . . 0.80000000000000004 109.761 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt 67.92 5.22 4.4 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.279 -0.873 . . . . 2.1099999999999999 112.764 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.428 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.5 OUTLIER -95.48 126.88 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 108.671 -0.863 . . . . 0.22 108.671 166.447 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.456 ' HA ' HG12 ' A' ' 8' ' ' ILE . 27.3 p -77.35 142.8 39.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.226 0.536 . . . . 1.0700000000000001 111.049 -175.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.92 -158.59 9.8 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 120.26 -0.971 . . . . 0.11 113.228 -177.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 35.1 mm -125.29 131.41 72.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 109.351 -0.611 . . . . 0.13 109.351 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.57 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -101.99 135.07 40.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 120.788 0.327 . . . . 0.13 110.144 -176.726 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.65 130.95 32.98 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.22 -0.446 . . . . 0.10000000000000001 111.024 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.439 HD13 ' CG2' ' A' ' 103' ' ' THR . 34.3 mt -85.03 137.44 20.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.271 0.557 . . . . 0.27000000000000002 110.171 177.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -109.31 105.05 14.3 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.144 -0.935 . . . . 1.24 111.232 -173.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.49 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -124.05 169.96 11.14 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.168 -0.469 . . . . 1.2 109.744 176.04 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.49 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.6 t70 80.96 -6.12 1.64 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 122.452 1.12 . . . . 0.57999999999999996 109.293 -173.077 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 23' ' ' SER . 32.4 m -102.33 -172.48 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-N 113.699 -1.591 . . . . 0.25 109.128 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.602 ' O ' HG23 ' A' ' 22' ' ' VAL . 19.9 m -72.07 167.48 31.42 Favored Pre-proline 0 C--N 1.316 -0.878 0 N-CA-C 105.687 -1.968 . . . . 1.1299999999999999 105.687 175.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 23' ' ' SER . 63.9 Cg_exo -41.7 127.39 3.47 Favored 'Trans proline' 0 C--N 1.352 0.719 0 CA-C-N 120.81 1.325 . . . . 0.16 112.728 -143.057 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.461 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -45.22 138.15 4.13 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 113.61 -1.632 . . . . 0.10000000000000001 112.739 -166.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.55 169.34 12.0 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 113.908 -1.496 . . . . 0.32000000000000001 111.615 -169.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.709 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.81 108.92 15.94 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 107.761 -1.2 . . . . 0.089999999999999997 107.761 173.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.3 m -104.26 108.26 19.57 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.015 0.436 . . . . 0.17000000000000001 111.176 -176.133 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.42 ' CD2' ' HB3' ' A' ' 9' ' ' PHE . 84.2 t90 -86.43 130.45 34.5 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.211 -0.662 . . . . 0.14000000000000001 109.211 172.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.52 ' HG2' HG23 ' A' ' 37' ' ' VAL . 78.1 mtt180 -123.36 157.3 33.62 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 109.027 -0.731 . . . . 1.9099999999999999 109.027 172.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.2 p -70.38 177.95 3.14 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.486 -0.561 . . . . 0.59999999999999998 109.486 178.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.2 p -62.45 -38.29 89.21 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.905 -0.718 . . . . 0.26000000000000001 110.405 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -78.8 -33.01 46.56 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.811 0.815 . . . . 2.1200000000000001 108.969 171.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.457 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 91.89 10.53 61.3 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 114.459 -1.246 . . . . 0.23000000000000001 112.637 177.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -65.44 -48.79 71.52 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.586 -0.524 . . . . 1.73 109.586 175.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.4 tttm -77.25 134.31 38.61 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.821 -0.807 . . . . 1.3 108.821 172.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.52 HG23 ' HG2' ' A' ' 30' ' ' ARG . 13.6 p -149.39 136.49 13.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 120.672 0.273 . . . . 0.17000000000000001 110.701 -177.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -144.49 132.85 21.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.667 0.27 . . . . 0.40999999999999998 110.316 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.434 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 37.0 m -116.52 133.43 56.02 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.501 0.556 . . . . 0.14999999999999999 112.501 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.709 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.44 129.8 53.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.599 0 N-CA-C 108.383 -0.969 . . . . 0.12 108.383 169.247 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.6 t -92.53 119.63 40.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 O-C-N 121.207 -0.933 . . . . 0.11 108.805 173.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.53 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -66.94 -18.18 65.26 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.984 0.735 . . . . 0.080000000000000002 112.984 -170.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.425 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 44.3 t -70.81 -14.94 62.6 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.204 -0.598 . . . . 0.87 109.624 175.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.447 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 3.5 p -109.34 9.97 25.61 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.517 -0.765 . . . . 0.14999999999999999 110.002 -178.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.56 HG21 HD13 ' A' ' 62' ' ' LEU . 31.0 mm -110.36 137.91 40.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.831 -0.622 . . . . 0.12 109.327 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -103.29 -40.22 6.49 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.319 -0.4 . . . . 0.52000000000000002 110.591 -175.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.591 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 25.2 mtpp -139.79 174.51 10.44 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.406 0.622 . . . . 1.4099999999999999 111.962 -178.314 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.637 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -152.92 137.57 16.9 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.785 -1.098 . . . . 0.72999999999999998 108.754 176.898 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -134.02 118.41 17.78 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 122.436 -0.165 . . . . 1.9399999999999999 111.416 -173.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.454 ' HB2' ' HG ' ' A' ' 60' ' ' LEU . . . -117.42 144.09 45.34 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 122.062 -0.399 . . . . 0.22 111.693 -177.671 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.514 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 74.2 p -70.67 121.28 83.25 Favored Pre-proline 0 N--CA 1.463 0.202 0 CA-C-N 115.884 -0.598 . . . . 0.26000000000000001 111.162 -175.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.56 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 22.6 Cg_exo -58.41 160.55 16.45 Favored 'Trans proline' 0 CA--C 1.528 0.204 0 C-N-CA 122.866 2.378 . . . . 0.38 111.939 175.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.16 -13.92 62.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 0.66000000000000003 111.364 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.3 p -91.87 -15.49 28.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.263 0.554 . . . . 1.5 110.547 176.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.56 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 20.9 m -71.85 143.26 49.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.618 -0.719 . . . . 0.84999999999999998 111.608 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -69.16 -8.32 44.44 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 114.951 -1.022 . . . . 1.77 110.653 176.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 30.5 mmtm -105.39 155.74 18.84 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 114.79 -1.095 . . . . 1.6299999999999999 111.121 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.514 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 72.5 mmm -133.0 98.27 4.24 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.174 -0.676 . . . . 1.1100000000000001 109.174 169.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.568 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.2 OUTLIER -157.88 160.59 37.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.01 -0.541 . . . . 0.22 111.562 -171.037 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -136.99 118.77 15.09 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.387 -0.968 . . . . 0.10000000000000001 108.387 176.748 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.482 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 2.2 mtp180 -103.64 136.87 42.55 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.211 0.529 . . . . 2.9900000000000002 111.439 -178.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.923 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -109.03 107.6 18.0 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.055 -0.975 . . . . 0.13 109.243 174.039 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.591 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.3 mp -85.56 101.7 10.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 110.137 -0.32 . . . . 0.28999999999999998 110.137 -174.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.479 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -65.25 153.62 50.64 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 116.111 -0.495 . . . . 0.54000000000000004 112.273 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.447 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 86.8 mttt -70.4 150.28 46.42 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.129 0.49 . . . . 0.55000000000000004 111.758 -176.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.452 ' CG2' ' HG3' ' A' ' 84' ' ' PRO . 0.8 OUTLIER -107.27 110.75 32.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 CA-C-N 115.677 -0.692 . . . . 1.73 111.67 -173.369 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.832 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 15.2 t70 -88.0 86.37 7.11 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 107.965 -1.124 . . . . 3.23 107.965 168.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -75.76 -9.09 58.3 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.773 0.321 . . . . 2.3900000000000001 110.963 -174.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.1 p -66.87 -9.52 38.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.061 0.458 . . . . 2.96 110.618 174.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.832 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 4.9 ptpp? -86.43 33.3 0.63 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.011 -0.541 . . . . 2.4900000000000002 110.386 173.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -43.72 113.33 0.5 Allowed 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.474 0.654 . . . . 3.3999999999999999 109.746 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.506 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 73.5 ttt180 -102.07 165.67 11.03 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 114.872 -1.058 . . . . 3.7999999999999998 109.064 -167.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 85.8 mttt -134.67 150.43 50.63 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.607 -0.516 . . . . 4.29 109.607 171.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.495 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.8 OUTLIER -84.69 -170.85 3.32 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.606 -0.725 . . . . 4.4100000000000001 110.416 -177.619 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -59.15 -32.13 69.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.772 0.32 . . . . 5.3399999999999999 111.619 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.495 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 19.4 mt-10 -80.68 -45.13 17.67 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.931 0.396 . . . . 5.3799999999999999 110.528 -179.066 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 130.77 17.08 1.55 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.69 -0.767 . . . . 4.3700000000000001 112.466 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.561 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 36.6 m-80 -76.03 133.7 40.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.703 -0.48 . . . . 4.5099999999999998 109.703 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.444 ' HA ' ' HG2' ' A' ' 73' ' ' LYS . 43.7 tt0 -71.16 93.76 1.09 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.255 0.55 . . . . 4.2800000000000002 110.499 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 28.3 m -98.75 100.17 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-O 121.727 0.775 . . . . 3.1000000000000001 109.455 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -86.88 107.48 14.37 Favored Pre-proline 0 C--N 1.316 -0.873 0 N-CA-C 108.715 -0.846 . . . . 2.5 108.715 176.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -58.1 139.05 89.04 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 123.535 2.824 . . . . 1.8700000000000001 113.579 -170.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.554 ' HB2' ' HD2' ' A' ' 84' ' ' PRO . 17.9 ptpt -80.46 168.91 22.1 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 114.73 -1.123 . . . . 2.7400000000000002 109.688 176.601 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.554 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 21.0 Cg_exo -57.05 150.29 57.27 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.006 1.804 . . . . 0.83999999999999997 112.251 -178.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -88.4 111.87 22.26 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.351 -0.981 . . . . 1.5700000000000001 108.351 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.427 ' HG2' HG13 ' A' ' 63' ' ' ILE . 95.8 mtt180 -104.47 115.24 30.02 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.887 -0.597 . . . . 2.52 110.196 -173.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.601 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 44.3 m80 -93.9 110.24 21.92 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.774 -0.824 . . . . 0.71999999999999997 108.774 -174.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.568 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 23.5 ttm -102.71 125.03 49.3 Favored 'General case' 0 CA--C 1.502 -0.87 0 C-N-CA 120.05 -0.66 . . . . 0.27000000000000002 111.012 -175.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.424 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.0 m-85 -112.83 125.33 54.23 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.271 -0.877 . . . . 0.27000000000000002 109.199 174.267 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.498 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -81.07 148.41 29.67 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.828 -0.434 . . . . 1.26 109.828 178.063 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.436 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 19.8 m-85 -130.01 168.57 16.5 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.283 0.563 . . . . 0.32000000000000001 111.783 -172.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -120.51 -11.11 9.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.143 -0.935 . . . . 2.3799999999999999 109.833 175.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.482 ' HB2' HG23 ' A' ' 96' ' ' VAL . 53.6 m-80 -136.85 128.67 29.06 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.373 0.606 . . . . 1.1000000000000001 110.814 -178.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.488 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.2 mmm180 -68.03 -35.91 79.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.117 -0.947 . . . . 3.0899999999999999 111.881 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.0 m -61.63 -37.97 85.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.783 0.325 . . . . 0.34999999999999998 110.747 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.596 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.5 t -66.17 -58.41 6.78 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 CA-C-N 116.221 -0.445 . . . . 0.23000000000000001 110.468 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.512 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.0 ptp -55.8 -39.49 71.37 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.333 -0.394 . . . . 0.17000000000000001 111.286 -176.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.462 ' N ' ' HG3' ' A' ' 97' ' ' MET . 28.7 t70 -65.65 -39.25 91.19 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.87 -0.332 . . . . 0.34000000000000002 110.332 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -74.44 -40.13 62.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.175 -0.466 . . . . 1.3600000000000001 111.433 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.643 HG22 HD11 ' A' ' 104' ' ' LEU . 30.6 mm -61.72 -57.23 13.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 108.692 -0.855 . . . . 0.12 108.692 176.004 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.769 ' HA ' HD12 ' A' ' 104' ' ' LEU . 30.0 ttpt -50.66 -49.69 56.43 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 124.09 0.868 . . . . 0.79000000000000004 109.848 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.476 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.0 ttp -49.98 -52.65 32.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.562 -0.745 . . . . 0.28000000000000003 111.26 178.004 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.678 ' O ' HG13 ' A' ' 107' ' ' ILE . 23.3 m -59.68 -56.82 17.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.992 -0.549 . . . . 0.17999999999999999 110.169 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.923 HD13 HD21 ' A' ' 62' ' ' LEU . 26.4 mt -45.6 -54.79 7.13 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.207 -0.906 . . . . 0.089999999999999997 110.663 176.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.619 ' CG ' HD13 ' A' ' 48' ' ' LEU . 92.9 mt-30 -51.56 -46.33 63.36 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.704 -1.135 . . . . 1.2 112.488 177.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 102' ' ' MET . 85.5 mm-40 -67.14 -34.77 78.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.46 0.648 . . . . 2.3700000000000001 109.968 -179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.678 HG13 ' O ' ' A' ' 103' ' ' THR . 7.3 mt -71.35 -46.25 65.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 114.669 -1.15 . . . . 0.14999999999999999 110.924 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.637 HD12 HD11 ' A' ' 48' ' ' LEU . 6.3 mt -59.24 -42.13 86.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.255 -0.43 . . . . 0.19 111.287 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.417 ' HA ' ' HB3' ' A' ' 112' ' ' LYS . 26.0 t -57.09 -28.33 62.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.5 -0.318 . . . . 1.1399999999999999 111.12 -177.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -60.95 -39.0 87.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.408 0.623 . . . . 1.6399999999999999 109.938 176.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.425 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 21.0 m-85 -94.47 -16.23 23.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.265 -0.88 . . . . 0.65000000000000002 110.205 -178.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.452 ' HA ' ' OD2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -71.5 -28.51 63.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.527 -0.761 . . . . 0.76000000000000001 109.039 176.841 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.43 -2.28 45.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.259 -0.882 . . . . 2.27 110.23 172.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -109.48 9.65 25.37 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.329 -0.85 . . . . 1.2 110.248 175.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.452 ' OD2' ' HA ' ' A' ' 112' ' ' LYS . 39.9 m-20 . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.621 -0.704 . . . . 2.7200000000000002 110.184 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 111.77 -0.532 . . . . 19.890000000000001 111.77 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 520' ' ' SER . . . . . 0.432 ' HA ' ' HD3' ' B' ' 521' ' ' PRO . 35.3 t -160.56 131.43 3.75 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 110.179 -0.304 . . . . 18.329999999999998 110.179 -179.025 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 521' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' B' ' 520' ' ' SER . 36.7 Cg_exo -64.63 -7.52 14.81 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 123.107 2.538 . . . . 17.390000000000001 112.307 176.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 94.38 -121.24 6.65 Favored Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 121.008 -0.615 . . . . 16.359999999999999 111.831 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -138.34 139.17 24.33 Favored Pre-proline 0 C--N 1.32 -0.687 0 N-CA-C 110.358 -0.238 . . . . 16.0 110.358 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -54.55 119.34 6.26 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.09 2.527 . . . . 13.15 112.335 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -87.75 -24.63 23.75 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.097 -0.501 . . . . 12.359999999999999 110.596 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -99.95 29.8 11.39 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.621 -0.799 . . . . 9.6300000000000008 112.731 -175.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 1.3 pp -80.95 6.37 13.54 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.36 0.6 . . . . 8.3399999999999999 111.57 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 30.4 tp -81.14 5.65 16.16 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.346 -0.983 . . . . 10.41 108.346 172.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 30.4 t -151.62 -47.62 0.11 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.304 -1.316 . . . . 7.6200000000000001 109.248 -177.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 95.41 -41.43 2.48 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.865 -0.683 . . . . 5.1900000000000004 112.616 176.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -91.64 -14.99 29.2 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 122.306 1.05 . . . . 5.5 108.99 -174.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -101.9 2.49 38.1 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 113.962 -1.472 . . . . 5.6799999999999997 110.95 -175.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -85.72 -32.32 21.97 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.725 -1.125 . . . . 3.2200000000000002 109.996 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -70.21 -34.03 72.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.647 -0.706 . . . . 4.2699999999999996 110.526 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 1.4 p -77.42 -17.03 58.49 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.56 -0.746 . . . . 1.25 110.861 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 536' ' ' SER . . . . . 0.49 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 64.5 m -78.14 -34.02 50.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.149 0.499 . . . . 2.0800000000000001 110.115 175.064 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 28.5 mm -82.75 -32.28 9.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.095 -0.502 . . . . 1.29 110.024 174.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 538' ' ' ALA . . . . . 0.423 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -75.88 1.08 16.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.796 0.808 . . . . 0.76000000000000001 110.318 174.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.49 ' HB3' ' O ' ' B' ' 536' ' ' SER . 25.2 t70 -81.33 -40.85 22.95 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.848 -1.069 . . . . 1.23 108.548 171.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 91.5 mtp -64.08 -31.62 72.88 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.678 -1.146 . . . . 2.29 109.798 174.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 541' ' ' ASP . . . . . 0.423 ' HB2' ' HA ' ' B' ' 538' ' ' ALA . 4.7 t70 -55.14 -43.71 74.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.146 -0.934 . . . . 1.1799999999999999 110.198 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.42 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -66.8 -36.72 83.03 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.594 -0.73 . . . . 0.56000000000000005 111.251 -177.054 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 32.9 t -59.92 -34.57 73.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.918 -0.583 . . . . 1.5800000000000001 110.369 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 544' ' ' ALA . . . . . 0.467 ' O ' ' HG2' ' B' ' 548' ' ' GLN . . . -80.56 -17.95 49.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.94 -0.573 . . . . 0.83999999999999997 111.472 -179.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 72.6 mt -88.14 -45.93 9.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.989 0.423 . . . . 1.0800000000000001 112.096 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 17.5 mt -74.51 -14.72 60.85 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.32 0.581 . . . . 0.96999999999999997 110.702 -175.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 25.3 p -79.6 -19.66 48.78 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.584 -0.735 . . . . 1.4199999999999999 110.419 174.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 548' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' B' ' 544' ' ' ALA . 14.8 mm100 -69.6 -40.22 76.78 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.545 0.688 . . . . 2.6699999999999999 110.732 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 549' ' ' ILE . . . . . 0.476 HD13 ' HG3' ' A' ' 52' ' ' PRO . 32.1 pt -94.21 28.8 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.678 -1.146 . . . . 5.2300000000000004 111.368 -177.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 35.0 t -92.47 -1.01 57.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.889 0.376 . . . . 6.4000000000000004 110.218 178.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 32.5 t . . . . . 0 C--O 1.246 0.917 0 CA-C-O 118.462 -0.78 . . . . 7.5899999999999999 109.341 177.364 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.404 ' HA ' ' OD1' ' A' ' 99' ' ' ASN . 5.3 Cg_endo . . . . . 0 N--CA 1.48 0.735 0 N-CA-C 110.569 -0.589 . . . . 1.8899999999999999 110.569 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.0 p -76.13 -21.46 56.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.753 0.311 . . . . 2.0499999999999998 111.244 -177.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.58 ' HA ' HD12 ' A' ' 18' ' ' ILE . 77.2 m80 64.65 -0.32 0.98 Allowed 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.807 -0.633 . . . . 0.75 112.304 178.294 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.8 p -157.78 161.77 38.45 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 119.72 -0.792 . . . . 1.0900000000000001 112.376 -175.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.491 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.02 -165.72 34.84 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 115.009 -0.996 . . . . 0.16 110.749 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.19 130.55 45.51 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.23 0.515 . . . . 0.16 110.44 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.4 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -144.63 143.58 30.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.043 0.449 . . . . 0.11 111.351 -177.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' A' ' 13' ' ' SER . 74.2 mt -99.23 128.27 51.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.647 -0.501 . . . . 0.33000000000000002 109.647 174.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 12' ' ' VAL . 15.0 t80 -139.31 138.55 36.79 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.992 -0.744 . . . . 0.35999999999999999 108.992 178.022 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 64.35 24.88 13.34 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.65 0.594 . . . . 0.80000000000000004 109.494 -176.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp 65.72 1.02 1.64 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 114.992 -1.004 . . . . 2.1099999999999999 113.027 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -94.53 130.06 43.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.863 -0.791 . . . . 0.22 108.863 168.688 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.434 ' HA ' HG12 ' A' ' 8' ' ' ILE . 20.4 m -78.68 144.08 35.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.824 0.345 . . . . 1.0700000000000001 110.609 -175.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.401 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -162.34 -158.97 9.92 Favored Glycine 0 N--CA 1.439 -1.148 0 C-N-CA 119.92 -1.133 . . . . 0.11 113.743 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.4 mm -127.59 134.53 65.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.862 -0.792 . . . . 0.13 108.862 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.556 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.97 136.91 36.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.603 -0.271 . . . . 0.13 110.337 -176.034 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.68 130.03 31.52 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.911 0.386 . . . . 0.10000000000000001 111.436 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.58 HD12 ' HA ' ' A' ' 3' ' ' HIS . 64.3 mt -86.2 135.45 25.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.308 -0.405 . . . . 0.27000000000000002 110.022 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -106.75 103.36 12.78 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.005 -0.543 . . . . 1.24 110.902 -175.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 21.1 mt-10 -119.2 169.47 9.93 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.81 -0.811 . . . . 1.2 108.81 175.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 36.3 t70 78.97 -2.25 2.28 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.445 1.117 . . . . 0.57999999999999996 109.443 -176.092 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 23' ' ' SER . 34.8 m -104.0 -173.01 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-N 113.675 -1.602 . . . . 0.25 110.314 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.627 ' O ' HG23 ' A' ' 22' ' ' VAL . 75.6 m -72.06 167.63 30.02 Favored Pre-proline 0 C--N 1.316 -0.889 0 N-CA-C 105.23 -2.137 . . . . 1.1299999999999999 105.23 172.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -41.77 129.06 3.93 Favored 'Trans proline' 0 C--N 1.355 0.917 0 CA-C-N 121.345 1.516 . . . . 0.16 112.577 -144.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.479 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.77 142.64 18.31 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 114.124 -1.398 . . . . 0.10000000000000001 112.336 -163.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.26 169.11 13.86 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 114.332 -1.304 . . . . 0.32000000000000001 111.787 -169.132 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.718 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -120.75 105.5 10.8 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.803 -1.184 . . . . 0.089999999999999997 107.803 174.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.9 m -102.48 107.5 18.49 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 121.072 0.463 . . . . 0.17000000000000001 111.414 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.406 ' CD2' ' HB3' ' A' ' 9' ' ' PHE . 84.8 t90 -85.17 132.32 34.31 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.222 -0.659 . . . . 0.14000000000000001 109.222 172.254 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HG2' HG23 ' A' ' 37' ' ' VAL . 63.7 mtt180 -125.75 159.37 32.53 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 108.92 -0.77 . . . . 1.9099999999999999 108.92 173.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 p -69.25 176.44 3.3 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 109.31 -0.626 . . . . 0.59999999999999998 109.31 178.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.401 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.8 p -57.87 -41.39 82.34 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.403 -0.519 . . . . 0.26000000000000001 111.205 -178.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.86 -32.09 21.89 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.389 -0.597 . . . . 2.1200000000000001 109.389 171.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.431 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 101.01 17.33 23.16 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.457 -0.792 . . . . 0.23000000000000001 113.84 172.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.77 -44.36 77.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.253 0.526 . . . . 1.73 109.752 174.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.6 tttm -82.98 137.22 34.25 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.644 -0.872 . . . . 1.3 108.644 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.444 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.4 p -149.89 138.49 14.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.799 0.333 . . . . 0.17000000000000001 111.432 -176.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -143.98 126.45 15.88 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.618 -0.512 . . . . 0.40999999999999998 109.618 176.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 92.2 m -111.64 136.44 50.86 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.135 0.42 . . . . 0.14999999999999999 112.135 -176.081 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.718 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.37 128.61 57.73 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.704 0 N-CA-C 108.154 -1.054 . . . . 0.12 108.154 169.904 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.438 ' O ' HG12 ' A' ' 45' ' ' ILE . 70.5 t -92.73 121.62 43.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 O-C-N 121.108 -0.995 . . . . 0.11 108.773 173.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.8 -17.08 63.39 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.923 0.712 . . . . 0.080000000000000002 112.923 -169.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.9 p -72.04 -11.63 60.85 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.205 -0.598 . . . . 0.87 109.557 174.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 p -111.4 9.09 21.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.615 -0.721 . . . . 0.14999999999999999 109.711 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.586 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.8 mm -113.33 141.49 28.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 108.963 -0.754 . . . . 0.12 108.963 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -107.08 -44.69 4.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.982 0.42 . . . . 0.52000000000000002 110.489 -179.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.598 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 24.5 mtpp -133.0 172.16 13.0 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-O 121.711 0.767 . . . . 1.4099999999999999 111.895 -175.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.622 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -153.28 138.93 17.84 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.332 -1.304 . . . . 0.72999999999999998 108.284 178.414 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -137.23 118.56 14.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 117.736 0.244 . . . . 1.9399999999999999 110.914 -173.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.47 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -115.04 141.6 47.77 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.715 0.293 . . . . 0.22 111.358 -177.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.47 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 73.3 p -65.68 120.29 67.31 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 115.764 -0.653 . . . . 0.26000000000000001 111.01 -176.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.538 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 10.4 Cg_exo -60.42 161.51 20.19 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.395 2.063 . . . . 0.38 111.54 176.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.09 -21.48 65.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.66000000000000003 110.92 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.4 p -78.81 -18.17 54.52 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.917 -0.583 . . . . 1.5 110.614 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.538 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 37.8 m -75.93 139.53 41.64 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.701 -0.681 . . . . 0.84999999999999998 111.143 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.36 -11.92 46.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.129 -0.941 . . . . 1.77 110.712 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.445 ' HB3' HG21 ' A' ' 51' ' ' THR . 9.5 mptt -102.5 155.39 18.3 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 114.748 -1.115 . . . . 1.6299999999999999 111.783 -174.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.47 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 71.9 mmm -130.77 99.38 4.92 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.359 -0.837 . . . . 1.1100000000000001 109.296 170.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.464 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.6 OUTLIER -156.06 157.65 36.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.751 -0.659 . . . . 0.22 111.674 -173.224 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.7 tt -132.01 119.31 20.89 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 108.353 -0.98 . . . . 0.10000000000000001 108.353 176.249 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.444 ' HA ' ' HA ' ' A' ' 88' ' ' MET . 54.9 mtm180 -101.62 140.58 35.72 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 120.849 0.357 . . . . 2.9900000000000002 111.075 -178.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.933 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -116.72 105.25 12.2 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.429 -0.805 . . . . 0.13 109.403 175.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.598 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.5 mp -86.03 107.78 16.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 122.551 0.34 . . . . 0.28999999999999998 110.317 -173.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.684 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -62.26 164.11 24.94 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.989 -0.624 . . . . 0.54000000000000004 112.621 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -80.78 157.68 25.69 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.237 0.541 . . . . 0.55000000000000004 111.687 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.597 HG22 ' HG3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -114.28 110.12 30.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 115.519 -0.764 . . . . 1.73 111.252 -177.492 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.666 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 36.6 m-20 -90.6 78.24 6.29 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 108.569 -0.9 . . . . 3.23 108.569 169.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -68.42 -1.29 6.17 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.128 0.418 . . . . 2.3900000000000001 112.128 -171.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.0 p -67.33 -17.9 64.95 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.344 0.592 . . . . 2.96 109.789 169.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.666 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -78.65 32.65 0.2 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.41 -0.814 . . . . 2.4900000000000002 111.183 178.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.417 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 12.0 mmmt -45.67 113.87 0.67 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.087 -0.708 . . . . 3.3999999999999999 109.087 -175.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.547 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 36.0 ttm180 -105.55 165.49 11.11 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 115.78 -0.646 . . . . 3.7999999999999998 109.289 -169.262 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 96.7 mttt -136.93 140.78 42.51 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.669 -0.493 . . . . 4.29 109.669 173.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -86.26 -165.04 1.14 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.221 -0.445 . . . . 4.4100000000000001 110.587 -176.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -60.95 -30.83 70.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 5.3399999999999999 111.317 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -82.95 -21.96 33.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.801 0.334 . . . . 5.3799999999999999 110.739 -177.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.99 14.19 37.35 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.139 -0.784 . . . . 4.3700000000000001 111.139 -175.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 80.0 m-20 -69.63 132.34 46.03 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 109.23 -0.655 . . . . 4.5099999999999998 109.23 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -70.73 92.91 0.9 Allowed 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.348 -0.612 . . . . 4.2800000000000002 109.348 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.547 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 17.4 m -101.22 98.62 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 CA-C-O 121.725 0.774 . . . . 3.1000000000000001 109.418 177.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -85.65 102.69 2.76 Favored Pre-proline 0 C--N 1.314 -0.965 0 N-CA-C 108.366 -0.976 . . . . 2.5 108.366 175.229 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 46.5 Cg_exo -59.39 132.2 44.99 Favored 'Trans proline' 0 CA--C 1.516 -0.39 0 C-N-CA 123.357 2.705 . . . . 1.8700000000000001 113.478 -165.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -73.76 165.45 53.08 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 114.189 -1.369 . . . . 2.7400000000000002 109.988 178.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.684 ' HB3' ' O ' ' A' ' 64' ' ' GLY . 16.9 Cg_exo -61.23 147.88 94.39 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 121.842 1.695 . . . . 0.83999999999999997 112.248 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -91.8 115.64 28.23 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.602 -0.726 . . . . 1.5700000000000001 109.242 177.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.2 mtt-85 -100.21 120.54 40.05 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.388 -0.824 . . . . 2.52 110.123 -173.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 50.8 m80 -95.48 111.0 22.98 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.432 -0.804 . . . . 0.71999999999999997 108.96 -177.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.444 ' HA ' ' HA ' ' A' ' 61' ' ' ARG . 30.5 ttm -107.51 125.76 51.68 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 119.795 -0.762 . . . . 0.27000000000000002 111.254 -176.36 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.4 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.8 m-85 -114.05 129.1 56.63 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.263 -0.88 . . . . 0.27000000000000002 109.498 177.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.24 149.31 29.08 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.076 0.465 . . . . 1.26 110.275 178.041 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.424 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.7 m-85 -132.06 173.81 10.83 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.932 -0.576 . . . . 0.32000000000000001 110.682 -175.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -123.11 -20.89 5.59 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.953 -0.567 . . . . 2.3799999999999999 110.116 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 -126.33 123.44 38.03 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.054 0.454 . . . . 1.1000000000000001 110.786 -177.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.526 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 15.4 mmm180 -60.77 -33.31 72.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.504 -0.771 . . . . 3.0899999999999999 112.654 179.063 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.8 m -64.38 -37.96 89.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.786 0.327 . . . . 0.34999999999999998 110.819 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.626 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.4 t -66.23 -56.19 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 CA-C-N 116.299 -0.41 . . . . 0.23000000000000001 110.489 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.588 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.8 ptp -57.24 -39.28 75.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.97 -0.559 . . . . 0.17000000000000001 110.828 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.482 ' N ' ' HG3' ' A' ' 97' ' ' MET . 32.4 t70 -66.63 -41.06 88.91 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 120.722 -0.391 . . . . 0.34000000000000002 110.451 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.404 ' OD1' ' HA ' ' A' ' 1' ' ' PRO . 1.4 t-20 -69.22 -44.11 72.72 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.114 0.259 . . . . 1.3600000000000001 111.08 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.635 HG22 HD11 ' A' ' 104' ' ' LEU . 31.7 mm -61.09 -57.76 10.67 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 108.81 -0.811 . . . . 0.12 108.81 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.803 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.5 ttpt -50.83 -48.39 59.91 Favored 'General case' 0 C--O 1.215 -0.75 0 O-C-N 123.927 0.767 . . . . 0.79000000000000004 109.863 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.704 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 41.5 ttp -49.09 -56.99 7.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.716 -0.674 . . . . 0.28000000000000003 111.077 177.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.732 ' O ' HG13 ' A' ' 107' ' ' ILE . 26.0 m -58.72 -51.96 67.73 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.468 0.48 . . . . 0.17999999999999999 110.473 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.933 HD13 HD21 ' A' ' 62' ' ' LEU . 29.1 mt -48.48 -54.03 15.76 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 123.451 0.701 . . . . 0.089999999999999997 110.613 175.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.58 ' HG2' HD13 ' A' ' 48' ' ' LEU . 60.0 mt-30 -50.56 -44.99 56.83 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.701 -1.136 . . . . 1.2 111.825 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.704 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.9 mt-30 -63.29 -42.21 99.06 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 122.001 0.905 . . . . 2.3700000000000001 108.986 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.732 HG13 ' O ' ' A' ' 103' ' ' THR . 10.2 mt -66.1 -45.98 89.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 114.1 -1.409 . . . . 0.14999999999999999 111.311 -178.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.508 HD12 HD11 ' A' ' 48' ' ' LEU . 9.0 mt -64.21 -40.77 90.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.218 -0.446 . . . . 0.19 111.493 -178.169 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.4 t -58.54 -23.3 57.98 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.383 -0.371 . . . . 1.1399999999999999 110.965 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -66.1 -52.14 51.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.427 0.632 . . . . 1.6399999999999999 109.652 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -79.01 -11.67 60.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.475 -0.784 . . . . 0.65000000000000002 110.441 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.95 -40.51 75.41 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.747 -0.834 . . . . 0.76000000000000001 108.747 173.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -74.05 -39.55 63.44 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.327 -0.851 . . . . 2.27 109.98 175.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -95.17 55.49 1.79 Allowed 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.134 -0.939 . . . . 1.2 110.478 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 C--O 1.248 0.997 0 CA-C-N 115.445 -0.798 . . . . 2.7200000000000002 110.897 -177.777 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.642 0 N-CA-C 111.898 -0.481 . . . . 19.890000000000001 111.898 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 24.9 m -121.12 95.72 48.63 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 109.889 -0.412 . . . . 18.329999999999998 109.889 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -73.65 -12.05 24.36 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 123.162 2.575 . . . . 17.390000000000001 113.99 -174.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -147.29 141.94 9.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.063 -1.065 . . . . 16.359999999999999 113.047 -177.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -129.6 87.33 53.13 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.759 -0.46 . . . . 16.0 109.759 176.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -59.82 -57.32 0.85 Allowed 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.97 2.447 . . . . 13.15 112.396 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 54.58 65.69 1.44 Allowed 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.568 0.543 . . . . 12.359999999999999 111.583 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -147.17 -74.25 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.893 -0.67 . . . . 9.6300000000000008 111.792 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.468 ' N ' HD13 ' B' ' 527' ' ' LEU . 0.0 OUTLIER -132.44 29.17 4.28 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.73 0.3 . . . . 8.3399999999999999 111.217 177.303 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 2.7 tt -73.08 85.24 1.32 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.957 -0.757 . . . . 10.41 108.957 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 66.7 m 60.85 63.57 1.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.652 -0.704 . . . . 7.6200000000000001 110.122 -177.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -59.82 -63.33 5.18 Favored Glycine 0 N--CA 1.449 -0.481 0 CA-C-N 115.13 -0.941 . . . . 5.1900000000000004 112.514 -177.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -158.25 -41.55 0.06 Allowed 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.751 0.786 . . . . 5.5 110.409 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -80.09 -45.21 18.65 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.637 -1.165 . . . . 5.6799999999999997 109.956 -176.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -72.58 -26.31 61.66 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 113.171 -1.831 . . . . 3.2200000000000002 110.074 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -75.63 -45.3 38.14 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.374 -0.83 . . . . 4.2699999999999996 110.702 -176.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 7.8 p -65.67 -30.6 71.32 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.882 -0.599 . . . . 1.25 111.269 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 18.2 m -71.49 -36.34 71.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 2.0800000000000001 111.029 177.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 537' ' ' ILE . . . . . 0.454 HD13 ' HA ' ' B' ' 537' ' ' ILE . 7.5 mm -77.64 -37.53 24.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.897 0.38 . . . . 1.29 110.868 175.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -75.15 5.58 5.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.6 0.714 . . . . 0.76000000000000001 110.934 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 539' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -69.68 -40.04 76.6 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.113 -0.949 . . . . 1.23 108.718 167.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 50.7 mtm -67.08 -29.7 69.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 114.869 -1.059 . . . . 2.29 110.036 174.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -67.3 -53.75 26.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.515 0.674 . . . . 1.1799999999999999 109.836 176.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.407 ' HA ' HD12 ' B' ' 545' ' ' LEU . 0.1 OUTLIER -63.56 -34.32 77.55 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.692 -1.14 . . . . 0.56000000000000005 111.322 -173.611 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 22.5 t -64.1 -24.21 67.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.028 -0.533 . . . . 1.5800000000000001 110.737 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -91.5 -14.47 30.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.995 0.426 . . . . 0.83999999999999997 110.802 177.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.419 HD11 ' HD3' ' A' ' 57' ' ' LYS . 78.2 mt -82.18 -40.29 21.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.229 -0.442 . . . . 1.0800000000000001 111.498 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 20.8 mt -76.26 -22.08 55.55 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.274 0.559 . . . . 0.96999999999999997 110.026 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 36.1 p -96.96 33.38 1.91 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.291 -0.868 . . . . 1.4199999999999999 111.554 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -76.8 44.8 0.39 Allowed 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.393 0.616 . . . . 2.6699999999999999 110.543 175.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 26.2 pt -102.5 3.86 10.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.617 -0.72 . . . . 5.2300000000000004 110.94 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 22.9 m -102.71 14.54 31.69 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.263 0.554 . . . . 6.4000000000000004 110.214 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 C--O 1.248 0.987 0 CA-C-N 115.518 -0.765 . . . . 7.5899999999999999 109.686 177.756 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo . . . . . 0 N--CA 1.479 0.658 0 N-CA-C 111.191 -0.35 . . . . 1.8899999999999999 111.191 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.2 t -160.04 105.79 1.56 Allowed 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 109.012 -0.736 . . . . 2.0499999999999998 109.012 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.517 ' HA ' HD12 ' A' ' 18' ' ' ILE . 76.4 m80 -95.68 1.37 53.48 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.023 -0.535 . . . . 0.75 110.734 -178.647 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 t -152.53 149.08 28.12 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 118.885 -1.126 . . . . 1.0900000000000001 113.928 -170.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.489 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -169.28 -172.13 35.65 Favored Glycine 0 N--CA 1.439 -1.111 0 CA-C-N 113.668 -1.605 . . . . 0.16 109.745 177.201 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -91.53 132.38 36.32 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 117.834 0.817 . . . . 0.16 110.323 179.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.466 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -144.12 146.6 32.89 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.196 -0.456 . . . . 0.11 111.435 -177.728 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.558 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 98.3 mt -107.47 123.75 62.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.281 -0.418 . . . . 0.33000000000000002 110.706 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.424 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.0 t80 -127.19 137.54 52.95 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.305 -0.998 . . . . 0.35999999999999999 108.305 177.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 58.35 26.24 13.8 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 122.775 0.43 . . . . 0.80000000000000004 110.919 -178.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.4 mtmm 68.61 0.08 2.49 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.521 0.728 . . . . 2.1099999999999999 112.915 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.424 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -92.4 116.82 34.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 108.53 -0.915 . . . . 0.22 108.53 169.014 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.446 ' HA ' HG12 ' A' ' 8' ' ' ILE . 50.2 p -70.92 145.18 50.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.114 0.483 . . . . 1.0700000000000001 110.791 -176.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.0 -160.42 10.7 Favored Glycine 0 N--CA 1.436 -1.366 0 C-N-CA 120.297 -0.954 . . . . 0.11 113.087 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 23.0 mm -125.27 132.28 71.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.122 -0.695 . . . . 0.13 109.122 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.56 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -100.82 136.1 33.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 N-CA-C 109.856 -0.424 . . . . 0.13 109.856 -176.927 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.9 125.83 24.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.921 0.391 . . . . 0.10000000000000001 111.523 -179.689 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.551 HG12 HD23 ' A' ' 27' ' ' LEU . 74.5 mt -85.28 132.8 30.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.779 -0.452 . . . . 0.27000000000000002 109.779 177.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -102.98 102.29 12.33 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.967 -0.56 . . . . 1.24 110.792 -174.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 13.5 mt-10 -116.02 170.16 8.7 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.256 -0.646 . . . . 1.2 109.256 176.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.447 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 35.5 t70 78.21 -4.59 2.18 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 122.394 1.092 . . . . 0.57999999999999996 109.704 -176.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.672 HG23 ' O ' ' A' ' 23' ' ' SER . 32.5 m -103.15 -172.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-N 113.765 -1.561 . . . . 0.25 110.028 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.672 ' O ' HG23 ' A' ' 22' ' ' VAL . 58.2 m -72.89 169.65 16.65 Favored Pre-proline 0 C--N 1.315 -0.898 0 N-CA-C 105.686 -1.968 . . . . 1.1299999999999999 105.686 173.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -41.96 129.21 4.19 Favored 'Trans proline' 0 C--N 1.359 1.126 0 CA-C-N 121.538 1.585 . . . . 0.16 112.328 -145.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.473 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -55.97 141.99 37.52 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 114.262 -1.335 . . . . 0.10000000000000001 112.051 -161.445 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -123.47 168.94 11.9 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.568 -1.196 . . . . 0.32000000000000001 111.915 -169.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.76 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -120.08 105.28 10.86 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 107.69 -1.226 . . . . 0.089999999999999997 107.69 173.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.415 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.2 m -100.91 106.81 18.19 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 116.554 -0.294 . . . . 0.17000000000000001 110.854 -176.169 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.41 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 83.8 t90 -85.07 130.41 34.62 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.98 -0.748 . . . . 0.14000000000000001 108.98 171.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 58.0 mtt180 -126.46 155.2 42.62 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.067 -0.716 . . . . 1.9099999999999999 109.067 174.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -69.0 176.19 3.29 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 109.634 -0.506 . . . . 0.59999999999999998 109.634 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.7 p -61.24 -32.42 72.21 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.224 -0.59 . . . . 0.26000000000000001 110.272 177.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -86.65 -31.64 20.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.674 0.749 . . . . 2.1200000000000001 108.981 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.5 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 88.62 9.97 68.16 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.573 -1.194 . . . . 0.23000000000000001 112.498 176.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -64.14 -48.42 76.13 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.795 -0.817 . . . . 1.73 108.795 173.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -77.35 136.1 38.42 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.284 -0.871 . . . . 1.3 109.134 173.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.456 HG23 ' HG2' ' A' ' 30' ' ' ARG . 11.6 p -150.15 139.24 15.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 120.739 0.304 . . . . 0.17000000000000001 111.089 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -144.47 121.43 11.35 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.659 -0.497 . . . . 0.40999999999999998 109.659 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 32.3 m -109.47 133.23 53.34 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.194 0.442 . . . . 0.14999999999999999 112.194 -175.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.76 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.11 129.23 53.81 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.702 0 N-CA-C 108.253 -1.017 . . . . 0.12 108.253 169.919 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.4 t -92.92 121.77 43.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 O-C-N 121.036 -1.04 . . . . 0.11 108.769 173.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.558 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.67 -20.88 64.46 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.151 0.797 . . . . 0.080000000000000002 113.151 -169.115 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.1 p -68.62 -14.56 63.09 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.159 -0.616 . . . . 0.87 109.735 174.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.3 p -111.1 14.86 21.84 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.568 -0.742 . . . . 0.14999999999999999 109.703 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.541 HG21 HD13 ' A' ' 62' ' ' LEU . 24.1 mm -113.08 138.73 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 115.641 -0.709 . . . . 0.12 109.217 176.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -104.15 -40.53 6.12 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.204 -0.453 . . . . 0.52000000000000002 110.51 -176.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.455 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 11.2 mtmm -141.62 170.64 15.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.325 -0.398 . . . . 1.4099999999999999 110.93 -177.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.616 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -149.69 141.66 23.84 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.498 -0.927 . . . . 0.72999999999999998 108.498 176.871 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.5 ' HB3' HD11 ' B' ' 546' ' ' LEU . 18.0 mm-40 -136.77 114.7 11.38 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 117.362 0.074 . . . . 1.9399999999999999 111.069 -171.288 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.45 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -113.34 142.72 45.53 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.98 -0.45 . . . . 0.22 111.229 -179.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.58 ' N ' ' HZ ' ' B' ' 542' ' ' PHE . 34.8 p -62.01 122.32 71.44 Favored Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 115.822 -0.626 . . . . 0.26000000000000001 110.985 -176.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.521 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 15.1 Cg_exo -59.21 159.6 21.97 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.554 2.169 . . . . 0.38 111.303 177.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.19 -14.81 63.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 0.66000000000000003 110.857 -179.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 p -85.84 -17.19 36.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.631 -0.713 . . . . 1.5 110.845 176.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.521 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 45.2 m -78.73 135.67 37.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.717 -0.674 . . . . 0.84999999999999998 111.133 -179.133 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -56.44 -34.44 66.84 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.333 -0.849 . . . . 1.77 110.061 172.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.483 ' HB3' HG21 ' A' ' 51' ' ' THR . 8.3 mptt -76.25 152.12 36.61 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 113.992 -1.458 . . . . 1.6299999999999999 111.927 -174.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.445 ' HB3' ' HE3' ' A' ' 58' ' ' MET . 85.7 mmm -129.48 98.55 4.89 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.304 -0.862 . . . . 1.1100000000000001 108.691 171.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.479 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.1 OUTLIER -154.07 153.84 32.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.882 -0.599 . . . . 0.22 111.53 -172.069 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.8 tt -130.33 118.91 21.99 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.342 -0.984 . . . . 0.10000000000000001 108.342 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.655 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 1.6 mtp180 -103.41 149.21 25.02 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.458 0.647 . . . . 2.9900000000000002 111.775 -178.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.934 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -127.65 104.98 8.16 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.38 -1.282 . . . . 0.13 108.901 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.538 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -88.3 105.0 15.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 110.196 -0.298 . . . . 0.28999999999999998 110.196 -173.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.573 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -62.69 160.45 33.37 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 116.181 -0.463 . . . . 0.54000000000000004 112.464 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.2 mttt -81.62 115.04 20.71 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.654 0.74 . . . . 0.55000000000000004 112.664 -177.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.62 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 2.3 t -122.35 133.2 69.32 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-N 114.465 -1.243 . . . . 1.73 109.65 170.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.78 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 20.9 t70 -89.5 87.87 7.23 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.701 -0.681 . . . . 3.23 109.208 178.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.61 -4.52 4.23 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.865 0.691 . . . . 2.3900000000000001 112.865 -170.746 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.57 -1.65 47.1 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.092 0.472 . . . . 2.96 110.673 172.33 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.78 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.2 ptmt -81.39 40.14 0.55 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.92 -0.582 . . . . 2.4900000000000002 110.331 172.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.494 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 25.1 mmtm -43.53 114.32 0.62 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.705 -0.68 . . . . 3.3999999999999999 110.665 -173.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 44.9 ttt180 -95.57 162.92 13.43 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 108.093 -1.077 . . . . 3.7999999999999998 108.093 -175.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 20.0 mtpt -128.29 132.81 48.67 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.182 -0.673 . . . . 4.29 109.182 172.179 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -77.37 -171.92 2.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.63 -0.713 . . . . 4.4100000000000001 110.696 -174.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -59.52 -32.05 69.94 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.775 0.287 . . . . 5.3399999999999999 111.775 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.506 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 25.0 mt-10 -83.71 -19.06 35.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.031 0.443 . . . . 5.3799999999999999 110.926 -179.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.434 ' O ' ' HE2' ' A' ' 73' ' ' LYS . . . 95.89 31.19 7.48 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.953 -0.567 . . . . 4.3700000000000001 112.753 178.018 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.579 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 39.7 m-80 -92.35 148.17 22.34 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.046 -0.724 . . . . 4.5099999999999998 109.046 175.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -72.55 89.38 1.28 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.11 0.481 . . . . 4.2800000000000002 109.778 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.578 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 12.3 m -99.36 99.31 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.983 0 CA-C-O 121.884 0.849 . . . . 3.1000000000000001 109.076 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.494 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.4 OUTLIER -85.22 119.38 72.33 Favored Pre-proline 0 C--N 1.31 -1.121 0 CA-C-N 115.601 -0.727 . . . . 2.5 109.994 -178.597 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 52.8 Cg_exo -58.25 140.93 96.18 Favored 'Trans proline' 0 CA--C 1.513 -0.573 0 C-N-CA 122.638 2.225 . . . . 1.8700000000000001 112.274 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.73 148.6 35.1 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 115.587 -0.733 . . . . 2.7400000000000002 109.156 177.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.62 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 22.8 Cg_exo -62.73 148.22 93.68 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.249 1.966 . . . . 0.83999999999999997 110.686 176.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -84.26 114.39 21.8 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.6 0.714 . . . . 1.5700000000000001 109.944 -176.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.516 ' HG2' HG13 ' A' ' 63' ' ' ILE . 90.3 mtt180 -104.15 121.75 43.9 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 115.182 -0.917 . . . . 2.52 110.497 -172.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.561 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 80.3 m-70 -94.76 146.28 24.28 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 107.415 -1.328 . . . . 0.71999999999999997 107.415 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.655 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 8.1 ttm -141.1 125.49 17.6 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 119.049 0.84 . . . . 0.27000000000000002 110.931 176.379 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.466 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.6 m-85 -116.84 127.95 54.79 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.356 -0.838 . . . . 0.27000000000000002 109.654 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.558 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -80.93 150.72 28.88 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.717 0.294 . . . . 1.26 110.356 178.222 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.435 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 28.2 m-85 -133.46 175.47 9.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.515 0.674 . . . . 0.32000000000000001 111.649 -174.044 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -111.24 -29.44 7.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.952 -1.022 . . . . 2.3799999999999999 110.998 178.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -138.13 142.89 40.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.003 0.43 . . . . 1.1000000000000001 110.502 -177.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.61 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 11.0 mmm180 -64.99 -34.23 77.94 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.48 -0.782 . . . . 3.0899999999999999 111.011 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 57.0 m -58.74 -39.28 80.45 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.115 -0.493 . . . . 0.34999999999999998 110.626 -176.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.57 ' O ' HG12 ' A' ' 100' ' ' ILE . 9.7 t -67.15 -55.91 15.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.184 -0.462 . . . . 0.23000000000000001 110.026 177.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.61 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 14.0 ptp -61.86 -41.34 97.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.17000000000000001 111.237 -177.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.434 ' N ' ' HG3' ' A' ' 97' ' ' MET . 36.4 t70 -62.34 -37.1 84.36 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.394 -0.522 . . . . 0.34000000000000002 110.504 178.207 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -74.08 -43.46 57.62 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.332 -0.395 . . . . 1.3600000000000001 111.618 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.8 mm -63.71 -55.02 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 N-CA-C 108.962 -0.755 . . . . 0.12 108.962 176.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.875 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.8 ttpt -51.53 -45.48 62.98 Favored 'General case' 0 C--O 1.217 -0.609 0 O-C-N 123.574 0.546 . . . . 0.79000000000000004 109.783 177.22 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.624 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 38.8 ttp -50.91 -59.8 3.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.839 -0.619 . . . . 0.28000000000000003 111.308 177.15 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.794 ' O ' HG13 ' A' ' 107' ' ' ILE . 27.6 m -56.5 -49.77 73.75 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 123.471 0.482 . . . . 0.17999999999999999 110.263 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.934 HD13 HD21 ' A' ' 62' ' ' LEU . 30.9 mt -48.48 -55.32 11.28 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 123.026 0.53 . . . . 0.089999999999999997 110.579 174.13 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.547 ' HG2' HD13 ' A' ' 48' ' ' LEU . 63.1 mt-30 -54.22 -42.41 69.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.141 -0.936 . . . . 1.2 111.712 176.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.624 ' HG3' ' O ' ' A' ' 102' ' ' MET . 21.4 mt-30 -64.71 -28.64 69.73 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.769 0.795 . . . . 2.3700000000000001 109.457 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.794 HG13 ' O ' ' A' ' 103' ' ' THR . 10.7 mt -84.52 -45.34 17.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.672 -1.149 . . . . 0.14999999999999999 111.232 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.541 HD12 HD11 ' A' ' 48' ' ' LEU . 9.8 mt -63.24 -38.81 83.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.28 -0.418 . . . . 0.19 111.582 -177.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.424 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 4.7 p -57.75 -26.87 62.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.41 -0.359 . . . . 1.1399999999999999 111.351 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -62.6 -47.18 84.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.413 0.625 . . . . 1.6399999999999999 109.557 174.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -89.67 8.18 32.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.548 -0.751 . . . . 0.65000000000000002 110.186 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.424 ' CB ' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER -95.53 -16.56 22.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.631 -0.877 . . . . 0.76000000000000001 108.631 176.07 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -75.5 -37.66 60.02 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 107.977 -1.119 . . . . 2.27 107.977 167.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.23 -23.69 59.2 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 113.978 -1.464 . . . . 1.2 110.605 -179.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.424 ' OD2' ' HE2' ' A' ' 65' ' ' LYS . 9.0 t70 . . . . . 0 C--O 1.248 0.978 0 CA-C-N 114.637 -1.165 . . . . 2.7200000000000002 110.371 -178.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.775 0 N-CA-C 111.959 -0.457 . . . . 19.890000000000001 111.959 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 43.8 t -94.9 123.31 58.02 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.627 0.214 . . . . 18.329999999999998 110.468 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -81.65 6.17 5.82 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.761 2.308 . . . . 17.390000000000001 111.757 175.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 92.97 157.78 33.81 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.773 -0.649 . . . . 16.359999999999999 111.688 -177.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -117.78 95.82 48.52 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-O 120.522 0.201 . . . . 16.0 110.709 -178.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.2 151.25 54.68 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.49 2.126 . . . . 13.15 111.615 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -94.16 143.8 26.06 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.445 -0.343 . . . . 12.359999999999999 110.95 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -93.59 50.58 2.34 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.813 -0.708 . . . . 9.6300000000000008 111.927 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 2.7 pp -139.14 122.09 16.68 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.094 0.473 . . . . 8.3399999999999999 110.131 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 528' ' ' LEU . . . . . 0.411 ' H ' ' HB2' ' B' ' 533' ' ' ASP . 44.3 tp -98.53 -8.58 26.32 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.554 -1.276 . . . . 10.41 107.554 167.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 529' ' ' SER . . . . . 0.49 ' OG ' ' HB2' ' B' ' 532' ' ' GLU . 25.0 p -172.69 -31.99 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 112.939 -1.937 . . . . 7.6200000000000001 107.314 178.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 150.48 -74.88 0.26 Allowed Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 114.912 -1.04 . . . . 5.1900000000000004 112.828 168.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -99.15 -10.85 21.97 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 122.204 1.002 . . . . 5.5 108.905 -174.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 532' ' ' GLU . . . . . 0.545 ' HA ' ' OG ' ' B' ' 535' ' ' SER . 49.4 mt-10 -90.01 4.88 48.84 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.034 -1.439 . . . . 5.6799999999999997 110.361 -178.529 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 533' ' ' ASP . . . . . 0.429 ' O ' ' HB3' ' B' ' 536' ' ' SER . 13.2 t70 -89.87 -43.81 10.36 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.063 -1.426 . . . . 3.2200000000000002 109.949 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -66.51 -39.61 88.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.689 0.757 . . . . 4.2699999999999996 109.667 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 535' ' ' SER . . . . . 0.545 ' OG ' ' HA ' ' B' ' 532' ' ' GLU . 9.4 p -71.63 -11.13 60.69 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.949 -1.023 . . . . 1.25 110.496 176.41 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 536' ' ' SER . . . . . 0.495 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 26.4 t -75.2 -27.52 59.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.17 0.51 . . . . 2.0800000000000001 109.781 176.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 537' ' ' ILE . . . . . 0.441 ' O ' ' HB2' ' B' ' 540' ' ' MET . 22.2 mm -80.93 -31.14 12.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.476 -0.564 . . . . 1.29 109.476 172.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -76.18 -3.14 34.67 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.723 0.773 . . . . 0.76000000000000001 110.097 172.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' B' ' 536' ' ' SER . 22.2 t70 -80.69 -32.53 35.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.978 -1.01 . . . . 1.23 108.725 173.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 540' ' ' MET . . . . . 0.441 ' HB2' ' O ' ' B' ' 537' ' ' ILE . 84.5 mmm -57.83 -30.13 65.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.359 -1.291 . . . . 2.29 110.41 176.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -62.24 -43.83 97.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.33 -0.85 . . . . 1.1799999999999999 110.408 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.58 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -63.52 -34.33 77.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.229 -0.896 . . . . 0.56000000000000005 111.52 -173.479 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 16.9 t -60.28 -29.18 68.65 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.759 -0.655 . . . . 1.5800000000000001 110.806 -177.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -85.27 -18.84 32.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.318 -0.401 . . . . 0.83999999999999997 111.027 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 92.2 mt -84.12 -41.95 16.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.965 0.412 . . . . 1.0800000000000001 111.611 -177.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 546' ' ' LEU . . . . . 0.5 HD11 ' HB3' ' A' ' 49' ' ' GLN . 18.1 mt -76.86 -22.36 53.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.238 0.542 . . . . 0.96999999999999997 110.522 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 19.4 m -89.54 -61.24 1.74 Allowed 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.341 -0.845 . . . . 1.4199999999999999 110.42 176.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 47.84 56.74 6.78 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.325 0.583 . . . . 2.6699999999999999 111.744 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 1.4 tp -103.08 -37.81 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.058 0 CA-C-N 115.583 -0.735 . . . . 5.2300000000000004 109.725 175.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 17.0 m -119.53 40.3 3.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.025 -0.534 . . . . 6.4000000000000004 110.603 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 33.8 m . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.706 -0.664 . . . . 7.5899999999999999 110.572 -177.411 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo . . . . . 0 N--CA 1.472 0.255 0 N-CA-C 110.992 -0.426 . . . . 1.8899999999999999 110.992 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.8 m -69.84 -28.19 65.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.525 . . . . 2.0499999999999998 111.409 -177.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.623 ' HA ' HD12 ' A' ' 18' ' ' ILE . 77.8 m80 65.07 -3.21 0.63 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.835 0.68 . . . . 0.75 112.835 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.3 t -156.74 159.17 38.07 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 119.773 -0.771 . . . . 1.0900000000000001 112.131 -174.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.526 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.18 -168.82 39.78 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 114.478 -1.237 . . . . 0.16 110.099 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.7 131.93 39.99 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 117.49 0.645 . . . . 0.16 110.398 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.434 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -142.36 144.82 33.35 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.133 0.492 . . . . 0.11 111.561 -177.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.6 mt -111.52 119.45 59.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.883 -0.599 . . . . 0.33000000000000002 110.258 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -120.65 137.37 54.49 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.717 -0.846 . . . . 0.35999999999999999 108.717 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 54.74 26.57 7.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 122.737 0.415 . . . . 0.80000000000000004 111.019 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp 68.37 5.34 4.7 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.825 0.676 . . . . 2.1099999999999999 112.825 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.5 p -94.9 116.54 36.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 108.216 -1.031 . . . . 0.22 108.216 166.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.9 m -73.0 144.71 47.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.023 0.439 . . . . 1.0700000000000001 111.077 -175.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.0 -158.43 9.32 Favored Glycine 0 N--CA 1.437 -1.257 0 C-N-CA 120.686 -0.769 . . . . 0.11 112.803 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -125.95 134.62 66.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.184 -0.673 . . . . 0.13 109.184 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.586 HD11 HD11 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.14 135.34 39.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.983 -0.377 . . . . 0.13 109.983 -177.053 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.75 127.86 27.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.948 0.404 . . . . 0.10000000000000001 111.518 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.623 HD12 ' HA ' ' A' ' 3' ' ' HIS . 65.6 mt -86.02 133.75 28.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.169 -0.469 . . . . 0.27000000000000002 109.94 177.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -106.31 102.01 11.45 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.822 -0.626 . . . . 1.24 110.784 -174.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -116.28 169.35 9.36 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.189 -0.671 . . . . 1.2 109.189 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t70 76.7 -2.23 2.73 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 122.413 1.101 . . . . 0.57999999999999996 109.737 -176.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 23' ' ' SER . 33.3 m -103.47 -173.71 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 113.743 -1.572 . . . . 0.25 109.959 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.644 ' O ' HG23 ' A' ' 22' ' ' VAL . 59.5 m -72.96 168.56 23.48 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 105.306 -2.109 . . . . 1.1299999999999999 105.306 173.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.707 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 72.9 Cg_exo -40.7 128.32 2.58 Favored 'Trans proline' 0 C--N 1.356 0.941 0 CA-C-N 121.55 1.589 . . . . 0.16 112.821 -143.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.86 140.08 25.36 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 114.357 -1.292 . . . . 0.10000000000000001 112.039 -164.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -126.47 168.92 13.56 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.597 -1.183 . . . . 0.32000000000000001 112.076 -168.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.76 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -120.25 104.24 9.9 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 107.375 -1.343 . . . . 0.089999999999999997 107.375 174.098 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.7 m -101.69 107.87 19.23 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.07 0.462 . . . . 0.17000000000000001 111.116 -176.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -85.1 131.78 34.4 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.973 -0.751 . . . . 0.14000000000000001 108.973 172.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.487 ' HG2' HG23 ' A' ' 37' ' ' VAL . 96.3 mtt180 -126.2 158.15 36.38 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.156 -0.683 . . . . 1.9099999999999999 109.156 173.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -69.73 174.55 5.02 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.226 -0.657 . . . . 0.59999999999999998 109.226 178.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.6 p -60.96 -35.52 76.97 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 119.93 -0.708 . . . . 0.26000000000000001 110.504 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -85.58 -29.34 24.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.613 0.721 . . . . 2.1200000000000001 109.5 173.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.458 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 90.78 16.76 54.08 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 114.843 -1.072 . . . . 0.23000000000000001 112.68 175.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -69.1 -51.41 38.82 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.954 -0.758 . . . . 1.73 108.954 173.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.8 tttt -75.72 136.01 40.35 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.9 -0.778 . . . . 1.3 108.9 173.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.487 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.0 p -149.75 134.82 10.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 120.826 0.346 . . . . 0.17000000000000001 111.047 -177.095 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -143.87 121.09 11.53 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.977 -0.379 . . . . 0.40999999999999998 109.977 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.411 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 60.9 m -111.04 137.05 49.15 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.365 0.505 . . . . 0.14999999999999999 112.365 -174.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.76 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.85 130.18 56.27 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.668 0 N-CA-C 108.392 -0.966 . . . . 0.12 108.392 170.559 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.0 t -92.55 119.7 40.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 O-C-N 121.005 -1.059 . . . . 0.11 108.854 173.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.62 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -67.05 -22.82 65.85 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.662 0.615 . . . . 0.080000000000000002 112.662 -170.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.707 ' OG ' ' HB3' ' A' ' 24' ' ' PRO . 9.7 m -63.87 -18.39 64.12 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.57 0.7 . . . . 0.87 109.482 175.314 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.1 p -113.72 17.83 17.87 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.164 -0.925 . . . . 0.14999999999999999 110.034 -177.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.551 HD13 ' HA2' ' A' ' 64' ' ' GLY . 23.9 mm -113.95 140.82 32.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.896 -0.779 . . . . 0.12 108.896 176.041 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -102.4 -43.48 5.66 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.897 0.379 . . . . 0.52000000000000002 110.555 -176.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.476 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 17.2 mtmm -141.81 173.04 11.88 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.086 -0.507 . . . . 1.4099999999999999 110.988 -177.251 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.637 HD11 HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -151.57 148.63 28.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.621 -0.718 . . . . 0.72999999999999998 109.148 179.833 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.683 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 19.3 mm-40 -133.6 153.22 51.83 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 110.391 -0.226 . . . . 1.9399999999999999 110.391 -174.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.438 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -150.46 140.18 21.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.642 0.258 . . . . 0.22 110.785 176.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.457 HG21 ' HB3' ' A' ' 57' ' ' LYS . 40.9 p -66.3 118.06 49.52 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.614 -0.721 . . . . 0.26000000000000001 110.653 -177.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.412 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 12.7 Cg_exo -57.0 159.31 15.03 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.761 2.307 . . . . 0.38 111.897 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.44 -15.92 63.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.195 -0.457 . . . . 0.66000000000000003 111.316 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.7 m -83.53 -18.57 37.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.232 0.539 . . . . 1.5 110.998 175.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.412 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 73.2 m -79.29 138.31 37.7 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.492 -0.776 . . . . 0.84999999999999998 111.585 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -62.3 -30.89 71.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.244 -0.889 . . . . 1.77 110.317 174.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.564 ' HE3' ' OD2' ' B' ' 541' ' ' ASP . 1.9 mptp? -77.35 153.01 34.18 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 114.183 -1.371 . . . . 1.6299999999999999 111.64 -175.183 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.424 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 1.0 OUTLIER -129.3 98.5 4.9 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.886 -1.052 . . . . 1.1100000000000001 108.639 172.052 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.472 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.1 OUTLIER -154.64 159.7 40.97 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.351 0.595 . . . . 0.22 111.878 -173.687 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -140.96 119.31 12.17 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.69 -1.141 . . . . 0.10000000000000001 108.416 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.683 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 25.5 mtp180 -103.7 136.68 42.95 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 121.285 0.565 . . . . 2.9900000000000002 110.863 -179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.914 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -111.51 104.39 12.8 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.601 -0.727 . . . . 0.13 109.197 176.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.55 HG13 ' HG2' ' A' ' 86' ' ' ARG . 1.7 mp -86.53 101.85 11.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.946 -0.39 . . . . 0.28999999999999998 109.946 -174.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.551 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -61.49 163.97 21.45 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.783 -0.644 . . . . 0.54000000000000004 112.784 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.526 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 82.0 mttt -85.2 108.94 17.97 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-O 121.954 0.883 . . . . 0.55000000000000004 112.816 -177.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.552 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 11.9 t -124.68 127.3 72.69 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.611 0 CA-C-N 114.067 -1.424 . . . . 1.73 108.703 165.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.652 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 1.9 t70 -95.06 91.34 6.3 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 108.577 -0.897 . . . . 3.23 108.577 176.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.6 -7.61 3.51 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.881 0.697 . . . . 2.3900000000000001 112.881 -168.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.6 p -64.49 -19.47 65.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.306 0.574 . . . . 2.96 109.567 172.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.652 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.1 ptmt -76.41 40.49 0.22 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.382 -0.826 . . . . 2.4900000000000002 110.978 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.506 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 19.4 mmtm -44.21 113.48 0.54 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.508 -0.553 . . . . 3.3999999999999999 109.508 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.625 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 50.4 ttt180 -94.97 156.23 16.41 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.733 -0.84 . . . . 3.7999999999999998 108.733 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -130.36 134.62 47.3 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 121.333 0.587 . . . . 4.29 110.753 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -74.98 174.0 9.92 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.79 -1.096 . . . . 4.4100000000000001 110.157 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -51.94 -32.05 31.44 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.774 0.657 . . . . 5.3399999999999999 112.774 -174.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -87.66 7.56 29.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.696 0.284 . . . . 5.3799999999999999 111.428 -177.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.11 10.96 85.62 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.944 -0.646 . . . . 4.3700000000000001 112.011 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -72.08 131.62 43.09 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.342 -0.614 . . . . 4.5099999999999998 109.342 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -70.01 113.18 6.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.988 0.423 . . . . 4.2800000000000002 110.171 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.625 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 3.7 m -126.88 98.68 4.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 108.62 -0.882 . . . . 3.1000000000000001 108.62 176.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.506 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.6 p -97.17 124.67 48.57 Favored Pre-proline 0 C--N 1.311 -1.08 0 CA-C-N 115.63 -0.714 . . . . 2.5 111.045 -171.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.496 ' O ' HG11 ' A' ' 66' ' ' VAL . 48.4 Cg_exo -59.08 132.52 47.62 Favored 'Trans proline' 0 CA--C 1.513 -0.536 0 C-N-CA 123.0 2.467 . . . . 1.8700000000000001 112.707 -177.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -96.18 139.23 21.66 Favored Pre-proline 0 N--CA 1.432 -1.361 0 CA-C-N 114.869 -1.059 . . . . 2.7400000000000002 109.908 175.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.552 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 22.1 Cg_exo -61.72 146.5 96.64 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 121.798 1.665 . . . . 0.83999999999999997 110.611 176.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -86.01 112.48 21.26 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.339 -0.545 . . . . 1.5700000000000001 110.243 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.55 ' HG2' HG13 ' A' ' 63' ' ' ILE . 44.7 mtm180 -105.11 112.66 25.88 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-O 121.497 0.665 . . . . 2.52 110.847 -174.128 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.577 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 58.3 m-70 -96.84 109.92 22.52 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.145 -0.934 . . . . 0.71999999999999997 109.677 -175.282 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.578 ' CB ' ' HG2' ' A' ' 61' ' ' ARG . 14.5 ttm -106.43 120.69 42.55 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 119.768 -0.773 . . . . 0.27000000000000002 110.738 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.434 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.9 m-85 -111.46 130.62 55.66 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.075 -0.966 . . . . 0.27000000000000002 109.524 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.472 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.15 153.82 27.06 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.358 -0.608 . . . . 1.26 109.358 174.912 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.418 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 17.3 m-85 -131.27 172.93 11.58 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.436 0.636 . . . . 0.32000000000000001 111.915 -174.159 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -109.44 -22.48 11.99 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.623 -1.171 . . . . 2.3799999999999999 110.833 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.452 ' HB2' HG23 ' A' ' 96' ' ' VAL . 17.4 m120 -144.55 134.88 24.36 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.55 0.691 . . . . 1.1000000000000001 111.457 -176.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.438 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.2 mmm180 -59.32 -40.32 85.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.533 -1.212 . . . . 3.0899999999999999 112.593 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.464 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 28.8 m -62.21 -34.97 77.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.79 0.329 . . . . 0.34999999999999998 110.758 -178.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 100' ' ' ILE . 17.3 t -66.17 -57.1 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.415 0 CA-C-N 116.308 -0.406 . . . . 0.23000000000000001 110.476 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.525 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.4 ptp -58.22 -40.23 81.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.034 -0.53 . . . . 0.17000000000000001 111.016 -177.351 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 102' ' ' MET . 26.1 t70 -65.7 -41.38 92.43 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.418 -0.513 . . . . 0.34000000000000002 110.086 178.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 95' ' ' THR . 1.7 t-20 -68.3 -44.3 75.75 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.178 0.299 . . . . 1.3600000000000001 111.336 -179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.663 HG22 HD11 ' A' ' 104' ' ' LEU . 30.6 mm -61.51 -56.95 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 N-CA-C 108.684 -0.858 . . . . 0.12 108.684 178.098 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.788 ' HA ' HD12 ' A' ' 104' ' ' LEU . 30.6 ttpt -50.08 -49.94 49.73 Favored 'General case' 0 C--O 1.217 -0.632 0 O-C-N 124.052 0.845 . . . . 0.79000000000000004 109.821 176.589 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.576 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 49.9 ttp -49.26 -53.33 22.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.406 -0.815 . . . . 0.28000000000000003 111.289 178.014 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.689 ' O ' HG13 ' A' ' 107' ' ' ILE . 20.7 m -61.03 -54.93 38.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.178 -0.464 . . . . 0.17999999999999999 110.378 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.914 HD13 HD21 ' A' ' 62' ' ' LEU . 23.6 mt -46.72 -53.73 11.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.275 -0.875 . . . . 0.089999999999999997 110.646 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.582 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.9 mt-30 -51.97 -43.08 63.4 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.715 -1.129 . . . . 1.2 112.397 177.289 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 102' ' ' MET . 24.7 mm-40 -70.63 -30.11 66.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.736 0.779 . . . . 2.3700000000000001 109.897 -178.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.689 HG13 ' O ' ' A' ' 103' ' ' THR . 13.1 mt -75.98 -47.3 32.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 114.582 -1.19 . . . . 0.14999999999999999 111.028 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.637 HD12 HD11 ' A' ' 48' ' ' LEU . 8.5 mt -58.46 -43.09 86.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.968 -0.56 . . . . 0.19 112.444 -176.364 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.625 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 16.5 t -67.53 -17.98 64.86 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.933 0.346 . . . . 1.1399999999999999 111.933 -174.096 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -61.22 -31.95 71.73 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.499 -0.926 . . . . 1.6399999999999999 108.499 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.458 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 15.4 m-85 -105.59 12.99 30.6 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.607 -1.179 . . . . 0.65000000000000002 109.884 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.625 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 5.2 mmpt? -98.7 -38.6 9.04 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.631 -0.878 . . . . 0.76000000000000001 108.631 171.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.69 -21.98 37.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.994 -1.003 . . . . 2.27 110.239 173.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -130.33 69.67 1.45 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.471 -0.786 . . . . 1.2 109.679 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 C--O 1.246 0.879 0 CA-C-N 115.563 -0.744 . . . . 2.7200000000000002 111.063 -176.93 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.557 0 N-CA-C 111.874 -0.49 . . . . 19.890000000000001 111.874 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 19.8 p -75.67 124.89 88.97 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 120.586 0.231 . . . . 18.329999999999998 110.836 179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.73 46.02 1.92 Allowed 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.971 2.447 . . . . 17.390000000000001 112.734 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.48 1.32 60.84 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 116.022 -0.536 . . . . 16.359999999999999 113.246 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 60.23 93.73 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.284 0 CA-C-O 120.972 0.415 . . . . 16.0 110.982 -176.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -56.4 103.75 0.12 Allowed 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 123.228 2.619 . . . . 13.15 113.222 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -75.53 133.02 41.1 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.535 -0.543 . . . . 12.359999999999999 109.535 174.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 134.65 -32.46 2.61 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 110.739 -0.944 . . . . 9.6300000000000008 110.739 -175.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.402 HD21 ' HB2' ' B' ' 532' ' ' GLU . 5.0 tt -131.21 80.73 1.95 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.055 -0.72 . . . . 8.3399999999999999 109.055 174.57 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 39.3 tp -98.12 1.46 47.58 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 107.466 -1.309 . . . . 10.41 107.466 166.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 8.6 t -174.32 177.56 2.21 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 113.33 -1.759 . . . . 7.6200000000000001 107.373 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 129.69 -61.94 0.65 Allowed Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.184 -1.007 . . . . 5.1900000000000004 111.832 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -143.54 -33.55 0.43 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.855 0.836 . . . . 5.5 110.141 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 532' ' ' GLU . . . . . 0.697 ' HA ' ' OG ' ' B' ' 535' ' ' SER . 7.3 mt-10 -98.22 23.22 8.54 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 114.681 -1.145 . . . . 5.6799999999999997 110.407 -177.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.34 -29.12 60.95 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.399 -1.273 . . . . 3.2200000000000002 111.474 -177.361 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -114.75 -29.58 6.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.49 0.662 . . . . 4.2699999999999996 110.26 175.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 535' ' ' SER . . . . . 0.697 ' OG ' ' HA ' ' B' ' 532' ' ' GLU . 2.4 p -82.46 -3.72 56.23 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.365 -0.834 . . . . 1.25 111.932 -174.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 61.2 p -77.17 -43.37 34.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.712 0.768 . . . . 2.0800000000000001 109.161 171.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 49.5 mm -76.6 -35.31 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 115.064 -0.971 . . . . 1.29 109.58 177.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 538' ' ' ALA . . . . . 0.5 ' HB3' ' HA ' ' B' ' 535' ' ' SER . . . -78.01 -0.69 28.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.483 0.658 . . . . 0.76000000000000001 110.442 175.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' B' ' 535' ' ' SER . 35.3 t70 -85.22 -42.49 14.63 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.337 -0.986 . . . . 1.23 108.337 171.295 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 64.5 mmm -58.31 -32.13 68.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.424 -1.262 . . . . 2.29 109.785 171.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 541' ' ' ASP . . . . . 0.564 ' OD2' ' HE3' ' A' ' 57' ' ' LYS . 31.8 t70 -60.73 -41.65 95.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.926 -1.034 . . . . 1.1799999999999999 110.812 174.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.409 ' HZ ' ' C ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -76.67 -31.95 57.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.961 -0.563 . . . . 0.56000000000000005 111.206 -176.734 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 17.4 m -52.66 -43.1 65.29 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 122.74 0.416 . . . . 1.5800000000000001 112.065 -174.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -68.22 -32.71 73.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.007 0.432 . . . . 0.83999999999999997 111.029 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.741 ' O ' ' HG2' ' B' ' 548' ' ' GLN . 59.6 mt -78.83 -31.98 45.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.016 -0.538 . . . . 1.0800000000000001 111.306 -176.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 14.1 mt -77.55 -22.51 50.94 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.4 0.619 . . . . 0.96999999999999997 109.791 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 22.7 t -82.29 -51.8 7.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.928 -1.033 . . . . 1.4199999999999999 109.986 174.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 548' ' ' GLN . . . . . 0.741 ' HG2' ' O ' ' B' ' 545' ' ' LEU . 54.5 mm-40 48.97 76.47 0.12 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.299 0.571 . . . . 2.6699999999999999 111.811 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 35.0 pt -90.22 -13.1 9.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.764 -0.653 . . . . 5.2300000000000004 110.272 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 31.2 t 72.98 -54.7 0.69 Allowed 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.941 0.776 . . . . 6.4000000000000004 111.556 177.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 42.9 m . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.697 -0.668 . . . . 7.5899999999999999 110.217 -179.952 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.54 ' HA ' ' OD1' ' A' ' 99' ' ' ASN . 2.1 Cg_endo . . . . . 0 N--CA 1.476 0.455 0 N-CA-C 110.639 -0.562 . . . . 1.8899999999999999 110.639 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.8 t -136.19 151.23 49.5 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 120.972 0.415 . . . . 2.0499999999999998 110.256 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.509 ' CD2' HG21 ' A' ' 103' ' ' THR . 27.2 m80 -109.59 6.02 23.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.658 -0.701 . . . . 0.75 110.261 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.1 t -156.03 155.76 33.22 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 119.981 -0.687 . . . . 1.0900000000000001 112.411 -172.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.48 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -176.07 -163.84 29.32 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 110.523 -1.031 . . . . 0.16 110.523 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.9 130.08 46.05 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 117.308 0.554 . . . . 0.16 110.533 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.488 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -140.26 143.33 35.89 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.955 0.407 . . . . 0.11 111.548 -178.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.547 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 97.3 mt -106.89 109.24 27.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.076 -0.511 . . . . 0.33000000000000002 110.124 176.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -110.19 137.97 47.2 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.533 -0.914 . . . . 0.35999999999999999 108.533 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 53.59 25.84 5.21 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 122.705 0.402 . . . . 0.80000000000000004 111.154 -176.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt 69.52 5.08 4.98 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.521 0.563 . . . . 2.1099999999999999 112.521 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.432 HG13 ' CH2' ' A' ' 29' ' ' TRP . 2.2 p -94.28 120.53 43.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 107.809 -1.182 . . . . 0.22 107.809 167.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.478 ' HA ' HG12 ' A' ' 8' ' ' ILE . 78.3 p -73.04 142.83 47.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.291 -0.413 . . . . 1.0700000000000001 110.762 -175.082 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -163.07 -163.77 16.53 Favored Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.506 -0.854 . . . . 0.11 112.672 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.9 mm -123.41 133.85 67.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 109.293 -0.632 . . . . 0.13 109.293 -179.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.596 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.84 135.2 41.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 110.103 -0.332 . . . . 0.13 110.103 -176.257 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.45 129.99 29.81 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.693 0.282 . . . . 0.10000000000000001 111.254 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.445 HD13 ' HB ' ' A' ' 103' ' ' THR . 47.6 mt -85.89 132.86 30.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.478 0.656 . . . . 0.27000000000000002 110.439 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -102.82 104.92 15.23 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.748 -1.115 . . . . 1.24 111.064 -173.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -118.42 170.2 9.12 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.146 -0.687 . . . . 1.2 109.146 176.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.0 t70 79.26 -3.8 2.11 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 122.326 1.06 . . . . 0.57999999999999996 109.557 -176.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 23' ' ' SER . 30.2 m -102.99 -173.1 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-N 113.832 -1.531 . . . . 0.25 109.427 178.207 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.634 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.1 p -73.56 169.39 18.59 Favored Pre-proline 0 C--N 1.316 -0.858 0 N-CA-C 105.585 -2.006 . . . . 1.1299999999999999 105.585 175.095 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.422 ' O ' HG13 ' A' ' 41' ' ' VAL . 74.5 Cg_exo -40.83 129.42 2.78 Favored 'Trans proline' 0 C--N 1.358 1.073 0 CA-C-N 121.486 1.566 . . . . 0.16 112.628 -143.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.55 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -54.22 144.03 21.26 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 114.166 -1.379 . . . . 0.10000000000000001 112.158 -162.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -125.25 168.83 12.94 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.497 -1.229 . . . . 0.32000000000000001 111.864 -169.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.819 ' HB3' HG22 ' A' ' 40' ' ' VAL . 2.8 tm? -118.32 106.45 12.78 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 107.592 -1.262 . . . . 0.089999999999999997 107.592 173.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.1 m -103.31 106.95 17.58 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 120.904 0.383 . . . . 0.17000000000000001 111.027 -175.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.437 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 85.0 t90 -85.16 131.76 34.39 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.859 -0.793 . . . . 0.14000000000000001 108.859 172.024 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 65.1 mtt180 -126.24 159.59 32.61 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.287 -0.634 . . . . 1.9099999999999999 109.287 174.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.8 p -67.51 176.09 2.53 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.013 -0.736 . . . . 0.59999999999999998 109.013 177.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.9 p -59.59 -41.75 90.98 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.659 -0.65 . . . . 0.26000000000000001 111.013 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -82.82 -31.67 28.01 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.272 -0.64 . . . . 2.1200000000000001 109.272 171.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.445 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 101.48 17.22 22.45 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.161 -0.927 . . . . 0.23000000000000001 113.595 172.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -65.8 -52.04 54.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.203 0.501 . . . . 1.73 109.928 174.017 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.8 tttt -77.01 135.93 38.69 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 109.058 -0.719 . . . . 1.3 109.058 176.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 13.8 p -150.03 135.39 10.75 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 CA-C-O 120.91 0.386 . . . . 0.17000000000000001 111.137 -175.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -141.96 127.0 18.38 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.458 -0.571 . . . . 0.40999999999999998 109.458 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 29.2 m -115.64 131.72 56.85 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.139 0.422 . . . . 0.14999999999999999 112.139 -172.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.819 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -99.98 129.9 49.94 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 N-CA-C 107.851 -1.166 . . . . 0.12 107.851 168.422 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 45' ' ' ILE . 97.3 t -93.01 121.29 43.59 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 O-C-N 121.148 -0.97 . . . . 0.11 108.577 173.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.482 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.52 -17.11 64.09 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.564 0.579 . . . . 0.080000000000000002 112.564 -170.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.558 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 97.7 p -68.5 -19.49 64.54 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.964 -0.754 . . . . 0.87 108.964 174.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.7 p -109.21 15.55 23.12 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.897 -1.047 . . . . 0.14999999999999999 109.994 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.512 HD13 ' HA2' ' A' ' 64' ' ' GLY . 22.2 mm -114.62 141.38 31.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.402 -0.592 . . . . 0.12 109.402 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -102.01 -47.91 4.41 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.799 -0.637 . . . . 0.52000000000000002 110.648 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.701 ' O ' HD23 ' A' ' 48' ' ' LEU . 7.8 mtmm -141.86 169.56 17.35 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 120.599 0.238 . . . . 1.4099999999999999 111.337 -177.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.93 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -141.26 154.34 45.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.72 -0.845 . . . . 0.72999999999999998 108.72 175.856 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.624 ' HG3' HD11 ' A' ' 63' ' ' ILE . 23.5 mt-30 -135.74 145.55 46.74 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 109.365 -0.606 . . . . 1.9399999999999999 109.365 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.475 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -137.92 134.74 35.34 Favored 'General case' 0 C--N 1.319 -0.746 0 O-C-N 121.726 -0.609 . . . . 0.22 110.672 175.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.454 HG21 ' HB3' ' A' ' 57' ' ' LYS . 68.8 p -59.99 119.08 38.4 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.801 -0.636 . . . . 0.26000000000000001 110.704 -177.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.485 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 17.4 Cg_exo -57.21 162.19 9.97 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.664 2.242 . . . . 0.38 111.948 177.032 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.8 -19.6 64.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.084 -0.507 . . . . 0.66000000000000003 110.899 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 45.7 t -82.59 -18.15 42.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.921 -0.581 . . . . 1.5 110.594 176.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.485 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 48.1 m -76.09 137.8 40.37 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.84999999999999998 111.057 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.577 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 39.8 mt-10 -52.38 -35.38 51.42 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 122.038 0.923 . . . . 1.77 109.987 173.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.577 ' HD2' ' HB2' ' A' ' 56' ' ' GLU . 10.6 mptt -82.09 158.06 23.86 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.112 -1.404 . . . . 1.6299999999999999 112.984 -169.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.403 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.3 OUTLIER -130.68 96.65 4.15 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.585 -1.189 . . . . 1.1100000000000001 108.485 169.295 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.464 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.2 OUTLIER -155.16 154.43 32.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.237 0.541 . . . . 0.22 111.55 -173.799 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -131.0 120.68 23.84 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.452 -0.944 . . . . 0.10000000000000001 108.452 177.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.586 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 14.1 mtp180 -104.6 145.11 30.78 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.036 0.446 . . . . 2.9900000000000002 111.743 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.939 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -122.43 106.69 11.27 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.31 -0.859 . . . . 0.13 109.587 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.624 HD11 ' HG3' ' A' ' 49' ' ' GLN . 1.9 mp -85.19 99.39 7.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 C-N-CA 122.484 0.314 . . . . 0.28999999999999998 110.211 -174.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.512 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -72.57 145.13 36.65 Favored Glycine 0 C--O 1.221 -0.689 0 C-N-CA 120.971 -0.633 . . . . 0.54000000000000004 112.587 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.414 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 89.2 mttt -66.2 146.29 54.8 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 122.692 0.397 . . . . 0.55000000000000004 111.16 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.801 HG13 ' HA ' ' A' ' 84' ' ' PRO . 6.5 m -120.1 150.99 22.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.308 -0.557 . . . . 1.73 111.332 169.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.71 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 26.3 t70 -83.16 83.63 7.78 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.469 -0.937 . . . . 3.23 108.469 172.072 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -64.84 -4.68 4.69 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.702 0.63 . . . . 2.3900000000000001 112.702 -169.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.6 p -77.49 -4.04 43.52 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.08 0.467 . . . . 2.96 110.524 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.71 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -85.2 30.39 0.6 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.907 -0.588 . . . . 2.4900000000000002 110.669 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.451 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 20.0 mtmt -46.82 114.81 0.9 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.262 0.553 . . . . 3.3999999999999999 110.269 -174.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 55.6 ttt180 -89.11 168.62 12.18 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.611 -0.885 . . . . 3.7999999999999998 108.611 -169.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.633 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 58.1 mttp -131.13 140.08 49.92 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 118.298 0.499 . . . . 4.29 110.625 174.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 75' ' ' ASN . 9.1 t70 -83.61 -173.07 4.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.763 -0.653 . . . . 4.4100000000000001 110.323 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.402 ' H ' ' CG ' ' A' ' 74' ' ' ASP . 29.7 m-80 -59.56 -31.63 69.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.212 0.53 . . . . 5.3399999999999999 110.853 -177.07 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -87.35 1.43 53.34 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.969 -0.56 . . . . 5.3799999999999999 110.789 -177.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.26 7.74 84.59 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.753 -0.737 . . . . 4.3700000000000001 111.681 -175.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.633 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 51.1 m-20 -57.4 128.32 36.45 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 110.186 -0.301 . . . . 4.5099999999999998 110.186 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -73.59 90.12 1.76 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.676 -0.491 . . . . 4.2800000000000002 109.676 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.439 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 11.1 m -103.24 98.47 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-O 122.026 0.917 . . . . 3.1000000000000001 109.618 -178.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.489 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.2 p -88.1 119.78 70.47 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-N 115.57 -0.741 . . . . 2.5 109.736 -178.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 31.4 Cg_exo -63.16 134.52 46.13 Favored 'Trans proline' 0 CA--C 1.51 -0.712 0 C-N-CA 122.881 2.387 . . . . 1.8700000000000001 112.588 -173.647 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.485 ' HE3' ' O ' ' B' ' 523' ' ' TYR . 12.7 ptmm? -79.96 159.87 70.01 Favored Pre-proline 0 C--N 1.315 -0.917 0 CA-C-N 115.117 -0.947 . . . . 2.7400000000000002 108.558 174.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.801 ' HA ' HG13 ' A' ' 66' ' ' VAL . 32.0 Cg_exo -57.24 152.75 43.73 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.327 2.018 . . . . 0.83999999999999997 111.851 -177.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -64.59 164.21 12.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.494 -0.775 . . . . 1.5700000000000001 109.516 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.559 ' HG2' ' CZ ' ' A' ' 61' ' ' ARG . 44.0 ttt180 -155.74 110.51 2.92 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 122.289 1.043 . . . . 2.52 109.973 -178.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.593 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 66.0 m80 -95.71 152.2 18.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.738 -1.574 . . . . 0.71999999999999997 107.695 -176.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.586 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 26.3 ttm -141.87 129.52 21.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 119.183 0.901 . . . . 0.27000000000000002 111.77 174.384 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.488 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 4.7 m-85 -118.4 129.38 55.38 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.361 -0.836 . . . . 0.27000000000000002 109.527 178.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.547 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.03 153.13 27.57 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 121.996 -0.44 . . . . 1.26 110.526 177.217 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.428 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.0 m-85 -133.59 172.53 12.62 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 0.32000000000000001 111.133 -175.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -119.26 -11.58 9.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.567 -0.742 . . . . 2.3799999999999999 109.804 177.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.513 ' HB2' HG23 ' A' ' 96' ' ' VAL . 41.5 m-80 -142.66 131.01 22.2 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.212 0.53 . . . . 1.1000000000000001 110.633 -177.437 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.498 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.5 mmm180 -64.62 -34.2 77.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.196 -0.911 . . . . 3.0899999999999999 111.938 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.2 m -62.75 -36.23 82.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.883 0.373 . . . . 0.34999999999999998 110.824 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.566 ' O ' HG12 ' A' ' 100' ' ' ILE . 10.5 t -67.71 -56.11 14.41 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.399 0 CA-C-N 116.074 -0.512 . . . . 0.23000000000000001 110.306 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.581 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.8 ptp -58.45 -37.83 76.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.088 -0.505 . . . . 0.17000000000000001 111.041 -177.102 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -70.09 -26.25 63.89 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.973 -0.291 . . . . 0.34000000000000002 111.085 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.54 ' OD1' ' HA ' ' A' ' 1' ' ' PRO . 5.5 m-80 -85.93 -39.65 16.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.312 -0.403 . . . . 1.3600000000000001 111.034 178.425 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.66 HG22 HD11 ' A' ' 104' ' ' LEU . 29.0 mm -64.98 -56.44 15.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 108.729 -0.841 . . . . 0.12 108.729 176.362 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.686 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.0 ttpt -48.31 -47.75 36.41 Favored 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 123.894 0.746 . . . . 0.79000000000000004 110.161 175.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.724 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 36.2 ttp -50.89 -60.44 3.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.186 -0.915 . . . . 0.28000000000000003 111.084 178.111 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.757 ' O ' HG13 ' A' ' 107' ' ' ILE . 86.6 m -55.95 -53.84 52.03 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 123.49 0.494 . . . . 0.17999999999999999 110.75 -178.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.939 HD13 HD21 ' A' ' 62' ' ' LEU . 25.8 mt -46.54 -58.03 4.17 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.694 0.621 . . . . 0.089999999999999997 110.261 176.051 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.529 ' HG3' HD12 ' A' ' 48' ' ' LEU . 70.4 mt-30 -52.69 -44.56 66.36 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.303 -0.862 . . . . 1.2 112.511 175.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.724 ' HG3' ' O ' ' A' ' 102' ' ' MET . 48.3 mt-30 -62.07 -30.65 71.13 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.709 0.766 . . . . 2.3700000000000001 109.659 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.757 HG13 ' O ' ' A' ' 103' ' ' THR . 6.4 mt -81.75 -41.1 18.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 114.688 -1.142 . . . . 0.14999999999999999 111.297 -177.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.778 HD11 HD21 ' A' ' 48' ' ' LEU . 5.2 mt -60.27 -42.2 89.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 112.948 0.721 . . . . 0.19 112.948 -174.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.648 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 2.1 p -65.81 -16.35 63.72 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.573 -0.451 . . . . 1.1399999999999999 112.159 -175.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -63.06 -28.27 69.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.637 0.732 . . . . 1.6399999999999999 109.096 169.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.558 ' CG ' ' HA ' ' A' ' 43' ' ' SER . 29.0 m-85 -110.41 10.83 23.32 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.95 -1.023 . . . . 0.65000000000000002 110.309 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.648 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 9.2 mmpt? -94.44 -38.25 11.03 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.648 -0.871 . . . . 0.76000000000000001 108.648 171.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.95 -24.65 26.46 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.848 -1.069 . . . . 2.27 110.619 176.105 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -124.89 66.2 1.11 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.131 -0.486 . . . . 1.2 111.171 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 35.7 t70 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.557 -0.735 . . . . 2.7200000000000002 110.108 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.728 0 N-CA-C 111.783 -0.527 . . . . 19.890000000000001 111.783 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 20.7 m 60.44 70.7 0.95 Allowed Pre-proline 0 CA--C 1.53 0.208 0 CA-C-O 121.008 0.432 . . . . 18.329999999999998 111.059 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo -80.66 33.56 0.52 Allowed 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.977 2.452 . . . . 17.390000000000001 112.97 -177.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -69.18 -44.68 65.08 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 111.336 -0.706 . . . . 16.359999999999999 111.336 176.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 523' ' ' TYR . . . . . 0.485 ' O ' ' HE3' ' A' ' 83' ' ' LYS . 76.4 m-85 -121.56 91.04 48.35 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.298 -0.63 . . . . 16.0 109.298 174.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -71.31 -60.45 0.06 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.494 2.129 . . . . 13.15 112.119 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -168.89 178.0 4.74 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.778 -0.823 . . . . 12.359999999999999 108.778 -178.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -177.62 -129.33 1.25 Allowed Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.41 -0.676 . . . . 9.6300000000000008 111.41 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.589 HD13 ' H ' ' B' ' 527' ' ' LEU . 0.0 OUTLIER -79.94 46.23 0.78 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.359 0.6 . . . . 8.3399999999999999 110.99 177.818 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 528' ' ' LEU . . . . . 0.479 HD21 ' H ' ' A' ' 86' ' ' ARG . 7.1 tt -81.03 86.36 6.14 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.737 -0.665 . . . . 10.41 110.411 -173.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 23.9 m 59.36 16.49 5.12 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.37 -0.832 . . . . 7.6200000000000001 112.822 172.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 71.07 40.08 62.38 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.884 -0.674 . . . . 5.1900000000000004 112.416 -177.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -113.94 49.11 1.02 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.85 -1.167 . . . . 5.5 107.85 177.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -99.84 -6.93 26.02 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.272 -1.331 . . . . 5.6799999999999997 113.185 -164.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -97.68 -62.16 1.29 Allowed 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 113.026 0.75 . . . . 3.2200000000000002 113.026 -170.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 21.6 p90 -115.11 -35.01 4.84 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.373 0.606 . . . . 4.2699999999999996 110.87 -178.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 535' ' ' SER . . . . . 0.428 ' HA ' ' HB3' ' B' ' 538' ' ' ALA . 1.4 p -76.62 -3.35 37.28 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.412 -0.813 . . . . 1.25 110.132 178.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 536' ' ' SER . . . . . 0.53 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 22.7 p -74.64 -43.95 52.88 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.579 -0.737 . . . . 2.0800000000000001 109.735 171.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 35.9 mm -75.09 -37.22 40.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.536 -0.756 . . . . 1.29 109.953 176.477 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 538' ' ' ALA . . . . . 0.428 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -76.47 1.57 16.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.854 0.835 . . . . 0.76000000000000001 110.591 177.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.53 ' HB3' ' O ' ' B' ' 536' ' ' SER . 6.6 t70 -88.07 -53.08 4.9 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.687 -1.142 . . . . 1.23 109.079 173.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 42.3 ttp -55.97 -36.71 68.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.767 -1.106 . . . . 2.29 109.621 173.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 541' ' ' ASP . . . . . 0.538 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 2.0 t70 -55.17 -50.87 68.24 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.385 -1.28 . . . . 1.1799999999999999 111.018 177.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.581 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.3 OUTLIER -64.12 -37.43 87.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.095 0.474 . . . . 0.56000000000000005 111.013 -173.511 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 12.6 m -64.36 -21.72 66.72 Favored 'General case' 0 N--CA 1.435 -1.209 0 CA-C-N 115.885 -0.598 . . . . 1.5800000000000001 110.957 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -91.82 -23.51 19.66 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.027 -0.533 . . . . 0.83999999999999997 110.78 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 96.5 mt -75.86 -29.87 58.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.31 -0.404 . . . . 1.0800000000000001 111.648 -178.214 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 546' ' ' LEU . . . . . 0.515 HD11 ' HB3' ' A' ' 49' ' ' GLN . 56.7 mt -89.02 -5.91 57.57 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.712 0.768 . . . . 0.96999999999999997 109.009 173.035 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 28.7 t -115.78 41.26 2.58 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.448 -1.251 . . . . 1.4199999999999999 110.311 178.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -85.23 21.98 1.58 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.824 0.345 . . . . 2.6699999999999999 110.211 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 549' ' ' ILE . . . . . 0.403 ' O ' HG22 ' B' ' 549' ' ' ILE . 13.6 mt 62.61 21.98 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-O 121.821 0.82 . . . . 5.2300000000000004 110.074 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 23.5 m -137.88 43.09 2.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.692 -0.685 . . . . 6.4000000000000004 110.631 -175.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.675 -0.678 . . . . 7.5899999999999999 109.935 178.045 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.533 ' HA ' ' OD1' ' A' ' 99' ' ' ASN . 3.0 Cg_exo . . . . . 0 N--CA 1.478 0.57 0 N-CA-C 110.45 -0.635 . . . . 1.8899999999999999 110.45 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 p -86.9 143.19 27.53 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 121.215 0.531 . . . . 2.0499999999999998 110.809 -177.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.442 ' CD2' HG21 ' A' ' 103' ' ' THR . 50.8 m80 -99.44 8.05 44.91 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.693 -0.685 . . . . 0.75 110.341 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 43.3 t -157.05 157.6 34.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.544 0.687 . . . . 1.0900000000000001 112.409 -172.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.528 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.39 -167.16 37.0 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 109.813 -1.315 . . . . 0.16 109.813 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -93.73 135.62 34.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 118.008 0.904 . . . . 0.16 110.583 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.502 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -146.78 142.14 27.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.074 -0.512 . . . . 0.11 111.376 -177.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.789 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.0 mt -98.95 128.25 50.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 110.193 -0.299 . . . . 0.33000000000000002 110.193 174.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.482 ' HE2' ' ND1' ' A' ' 38' ' ' HIS . 10.7 t80 -135.19 140.48 45.36 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.756 -0.831 . . . . 0.35999999999999999 108.756 175.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 60.63 24.27 14.04 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.451 0.469 . . . . 0.80000000000000004 109.87 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt 69.49 -2.75 1.81 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.018 0.927 . . . . 2.1099999999999999 113.109 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -92.31 123.68 44.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 108.766 -0.828 . . . . 0.22 108.766 170.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.3 m -74.86 145.38 42.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.325 -0.398 . . . . 1.0700000000000001 110.362 -176.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.01 -158.53 10.15 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 119.869 -1.158 . . . . 0.11 113.497 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.4 mm -125.3 131.5 72.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.456 -0.572 . . . . 0.13 109.456 -177.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.544 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -101.55 136.15 34.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 110.005 -0.369 . . . . 0.13 110.005 -177.297 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.49 131.31 31.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.608 0.242 . . . . 0.10000000000000001 111.39 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.41 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 54.7 mt -86.21 138.41 19.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 121.211 0.529 . . . . 0.27000000000000002 110.403 176.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -109.83 105.23 14.36 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.928 -1.033 . . . . 1.24 111.246 -175.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.437 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 36.5 mt-10 -116.99 170.35 8.7 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.902 -0.777 . . . . 1.2 108.902 175.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.437 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 36.3 t70 78.58 -5.01 2.09 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.38 1.086 . . . . 0.57999999999999996 109.777 -177.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 23' ' ' SER . 31.1 m -102.62 -173.33 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 CA-C-N 113.872 -1.513 . . . . 0.25 109.824 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.649 ' O ' HG23 ' A' ' 22' ' ' VAL . 48.2 m -72.78 167.33 34.56 Favored Pre-proline 0 C--N 1.315 -0.914 0 N-CA-C 105.322 -2.103 . . . . 1.1299999999999999 105.322 174.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -41.49 127.62 3.28 Favored 'Trans proline' 0 C--N 1.352 0.736 0 CA-C-N 121.13 1.439 . . . . 0.16 112.534 -142.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.474 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -49.64 140.25 11.41 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 113.919 -1.491 . . . . 0.10000000000000001 112.434 -165.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -125.43 169.48 12.34 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 114.09 -1.414 . . . . 0.32000000000000001 111.585 -168.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.794 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -118.89 105.64 11.7 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 107.612 -1.255 . . . . 0.089999999999999997 107.612 173.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 m -100.67 106.48 17.94 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-O 120.973 0.416 . . . . 0.17000000000000001 110.743 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.3 t90 -85.01 132.02 34.39 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.91 -0.774 . . . . 0.14000000000000001 108.91 171.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.503 ' HG2' HG23 ' A' ' 37' ' ' VAL . 93.6 mtt180 -126.0 159.74 31.89 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.258 -0.645 . . . . 1.9099999999999999 109.258 174.015 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 p -70.71 177.68 3.44 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 110.077 -0.342 . . . . 0.59999999999999998 110.077 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 p -64.79 -23.19 67.16 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.398 -0.521 . . . . 0.26000000000000001 111.479 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -99.4 -31.63 11.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.644 0.735 . . . . 2.1200000000000001 109.054 169.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.466 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 98.49 16.59 31.39 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 114.712 -1.131 . . . . 0.23000000000000001 112.153 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -67.19 -39.63 86.4 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.263 -0.643 . . . . 1.73 109.263 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.8 tttm -93.68 141.21 28.74 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.412 -0.959 . . . . 1.3 108.412 175.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.503 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.1 p -147.31 136.89 16.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 120.963 0.411 . . . . 0.17000000000000001 111.007 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.482 ' ND1' ' HE2' ' A' ' 9' ' ' PHE . 3.3 t60 -143.67 118.07 9.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.275 -0.421 . . . . 0.40999999999999998 109.941 -178.102 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 24.7 m -110.79 133.79 53.05 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.409 0.522 . . . . 0.14999999999999999 112.409 -173.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.794 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.63 130.24 54.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 N-CA-C 108.103 -1.073 . . . . 0.12 108.103 168.543 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 90.4 t -93.34 120.4 42.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 O-C-N 121.202 -0.936 . . . . 0.11 108.754 173.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.553 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -68.14 -19.4 64.81 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.231 0.826 . . . . 0.080000000000000002 113.231 -169.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.564 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 9.8 p -70.2 -13.45 62.19 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.336 0.589 . . . . 0.87 109.641 175.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.4 p -108.66 11.28 26.63 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.477 -0.783 . . . . 0.14999999999999999 109.583 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.531 HG21 ' CD1' ' A' ' 62' ' ' LEU . 26.3 mm -113.83 144.68 20.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.102 -0.703 . . . . 0.12 109.102 178.593 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -110.77 -41.79 4.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.78 0.324 . . . . 0.52000000000000002 110.968 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.528 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 14.9 mtmt -140.33 174.39 10.56 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.106 0.479 . . . . 1.4099999999999999 111.029 -179.391 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.595 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -152.49 134.73 15.04 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.673 -0.862 . . . . 0.72999999999999998 108.673 -178.106 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -133.45 115.19 14.5 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 122.268 -0.27 . . . . 1.9399999999999999 111.289 -170.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.457 ' HB2' ' HG ' ' A' ' 60' ' ' LEU . . . -114.8 146.67 40.77 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.179 -0.326 . . . . 0.22 111.802 -175.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.492 ' N ' ' HZ ' ' B' ' 542' ' ' PHE . 80.5 p -72.44 120.91 83.15 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 115.922 -0.581 . . . . 0.26000000000000001 110.921 -176.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.604 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 10.0 Cg_exo -62.3 165.96 13.98 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.832 2.355 . . . . 0.38 111.921 175.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.89 -27.25 67.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.042 -0.526 . . . . 0.66000000000000003 111.313 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.5 m -84.91 -4.84 59.28 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.87 -0.605 . . . . 1.5 110.772 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.604 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 35.2 m -82.64 148.53 27.91 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.03 -0.532 . . . . 0.84999999999999998 111.635 178.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -70.52 7.04 1.17 Allowed 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.169 -0.923 . . . . 1.77 111.909 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.475 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 40.7 mmtm -130.26 153.3 48.76 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 115.171 -0.922 . . . . 1.6299999999999999 111.204 -167.265 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.462 ' O ' ' HG3' ' A' ' 59' ' ' MET . 80.1 mmm -125.61 97.23 5.08 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.565 -0.902 . . . . 1.1100000000000001 108.565 167.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.475 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.28 156.32 35.33 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.242 0.544 . . . . 0.22 111.983 -172.538 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.54 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.3 tt -135.17 118.88 17.11 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.435 -0.95 . . . . 0.10000000000000001 108.435 177.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.736 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.2 mtp180 -101.85 144.6 30.3 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.342 0.591 . . . . 2.9900000000000002 111.748 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.899 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -120.24 110.19 16.29 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.776 -1.102 . . . . 0.13 108.863 178.085 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.511 HG13 ' HG2' ' A' ' 86' ' ' ARG . 2.4 mp -88.88 100.91 11.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.135 0.493 . . . . 0.28999999999999998 110.475 -172.191 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.639 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -71.22 141.02 31.91 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.652 -0.704 . . . . 0.54000000000000004 112.615 -177.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.461 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 79.7 mttt -60.98 123.76 18.54 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.992 0.738 . . . . 0.55000000000000004 112.992 -174.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.72 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 2.0 t -120.3 139.76 46.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 114.933 -1.03 . . . . 1.73 109.744 171.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.505 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 5.3 m-20 -80.13 86.9 5.51 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 108.687 -0.856 . . . . 3.23 108.687 174.516 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 43.1 mt-10 -65.02 -2.58 2.8 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.606 0.241 . . . . 2.3900000000000001 111.618 -175.384 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.422 ' C ' ' H ' ' A' ' 71' ' ' LYS . 12.9 p -69.6 -13.26 62.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.388 0.613 . . . . 2.96 109.761 169.191 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.543 ' NZ ' ' HG2' ' A' ' 82' ' ' PRO . 13.6 ptmm? -75.34 29.69 0.1 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.164 -0.926 . . . . 2.4900000000000002 110.797 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 20.0 mtmt -48.09 114.66 0.97 Allowed 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.369 0.604 . . . . 3.3999999999999999 109.835 -174.492 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.528 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 79.3 ttt180 -92.91 165.65 12.78 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 114.976 -1.011 . . . . 3.7999999999999998 108.838 -171.333 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.42 ' HD3' ' O ' ' A' ' 77' ' ' GLY . 54.9 mttp -127.11 139.34 53.05 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.302 0.572 . . . . 4.29 109.919 171.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.432 ' CG ' ' H ' ' A' ' 75' ' ' ASN . 13.7 t70 -91.79 -165.33 1.33 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.175 -0.92 . . . . 4.4100000000000001 110.368 -174.471 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.432 ' H ' ' CG ' ' A' ' 74' ' ' ASP . 78.9 m-20 -62.71 -33.17 74.56 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.375 0.509 . . . . 5.3399999999999999 112.375 -169.11 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -84.28 1.62 43.97 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 111.67 0.248 . . . . 5.3799999999999999 111.67 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.42 ' O ' ' HD3' ' A' ' 73' ' ' LYS . . . 79.72 4.33 89.34 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.55 -0.833 . . . . 4.3700000000000001 111.422 -175.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -72.01 140.49 49.09 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.921 -0.4 . . . . 4.5099999999999998 109.921 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -68.98 116.87 9.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.105 -0.498 . . . . 4.2800000000000002 110.879 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 9.8 m -122.47 98.85 6.13 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 108.877 -0.786 . . . . 3.1000000000000001 108.877 173.021 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 1.2 p -86.31 109.94 27.34 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-O 121.235 0.541 . . . . 2.5 110.126 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.543 ' HG2' ' NZ ' ' A' ' 70' ' ' LYS . 52.5 Cg_exo -60.91 138.89 81.9 Favored 'Trans proline' 0 CA--C 1.513 -0.547 0 C-N-CA 123.549 2.833 . . . . 1.8700000000000001 112.279 -177.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 ptmm? -94.27 155.26 40.06 Favored Pre-proline 0 N--CA 1.442 -0.841 0 CA-C-N 115.167 -0.924 . . . . 2.7400000000000002 110.251 -175.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.72 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 72.8 Cg_exo -48.06 153.32 2.82 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.576 2.851 . . . . 0.83999999999999997 113.461 177.472 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.414 ' NE2' HD13 ' B' ' 528' ' ' LEU . 96.3 mt-30 -86.9 115.4 24.28 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 115.21 -0.904 . . . . 1.5700000000000001 109.679 -176.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.511 ' HG2' HG13 ' A' ' 63' ' ' ILE . 85.9 mtt180 -100.44 130.37 46.52 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-N 114.97 -1.014 . . . . 2.52 111.307 -171.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.515 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 56.9 m80 -95.87 145.88 25.02 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 106.954 -1.499 . . . . 0.71999999999999997 106.954 176.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.736 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 15.6 ttm -140.09 125.98 19.54 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 119.403 1.001 . . . . 0.27000000000000002 111.814 175.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.473 ' O ' ' HA ' ' A' ' 59' ' ' MET . 15.8 m-85 -108.12 158.07 17.74 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.965 -1.016 . . . . 0.27000000000000002 108.72 176.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.789 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -106.69 157.6 17.59 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 108.806 -0.812 . . . . 1.26 108.806 175.455 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.54 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 30.9 m-85 -139.39 170.46 15.88 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.011 0.434 . . . . 0.32000000000000001 111.615 -176.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -123.86 -5.78 7.98 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.593 -0.731 . . . . 2.3799999999999999 110.379 176.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.43 ' HB2' HG23 ' A' ' 96' ' ' VAL . 20.0 m120 -147.13 126.15 12.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.041 -0.527 . . . . 1.1000000000000001 109.918 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.631 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 13.8 mmm180 -61.52 -35.4 77.62 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 116.011 -0.541 . . . . 3.0899999999999999 110.994 177.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -56.85 -36.2 69.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.186 -0.461 . . . . 0.34999999999999998 110.423 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.633 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.6 t -69.18 -60.26 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.022 -0.536 . . . . 0.23000000000000001 110.329 176.495 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.631 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.5 ptp -57.93 -40.14 79.71 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 116.578 -0.283 . . . . 0.17000000000000001 110.813 -176.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.487 ' N ' ' HG3' ' A' ' 97' ' ' MET . 35.2 t70 -58.92 -44.44 91.31 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.477 -0.489 . . . . 0.34000000000000002 110.381 176.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.533 ' OD1' ' HA ' ' A' ' 1' ' ' PRO . 5.9 m-80 -72.24 -42.4 65.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.303 -0.408 . . . . 1.3600000000000001 111.927 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.633 HG12 ' O ' ' A' ' 96' ' ' VAL . 27.3 mm -61.94 -56.94 14.49 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 N-CA-C 108.833 -0.802 . . . . 0.12 108.833 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.737 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.7 ttpt -49.43 -52.69 27.22 Favored 'General case' 0 C--O 1.216 -0.683 0 O-C-N 123.934 0.771 . . . . 0.79000000000000004 109.762 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.557 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 39.1 ttp -48.17 -53.28 17.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.121 -0.945 . . . . 0.28000000000000003 111.474 178.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.732 ' O ' HG13 ' A' ' 107' ' ' ILE . 85.6 m -60.64 -54.51 44.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.134 -0.484 . . . . 0.17999999999999999 110.483 178.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.899 HD13 HD21 ' A' ' 62' ' ' LEU . 24.9 mt -47.9 -54.54 12.33 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.782 0.676 . . . . 0.089999999999999997 110.63 177.126 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.567 ' HG2' HD13 ' A' ' 48' ' ' LEU . 94.1 mt-30 -49.02 -49.0 43.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.391 -1.277 . . . . 1.2 111.923 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 102' ' ' MET . 27.6 mm-40 -67.77 -28.38 67.56 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.451 0.643 . . . . 2.3700000000000001 110.556 -177.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.732 HG13 ' O ' ' A' ' 103' ' ' THR . 8.2 mt -75.87 -41.18 39.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-N 115.128 -0.942 . . . . 0.14999999999999999 110.642 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.534 HD12 HD11 ' A' ' 48' ' ' LEU . 7.5 mt -65.16 -40.58 89.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.387 -0.369 . . . . 0.19 111.614 -178.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.2 p -61.02 -18.91 60.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.838 0.351 . . . . 1.1399999999999999 111.517 -177.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -66.58 -48.71 68.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.311 0.577 . . . . 1.6399999999999999 109.443 173.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.564 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 15.4 m-85 -77.48 -22.68 50.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.316 -0.857 . . . . 0.65000000000000002 109.859 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -21.43 65.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.019 -0.991 . . . . 0.76000000000000001 109.911 177.182 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -99.59 -37.71 9.04 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.823 -0.626 . . . . 2.27 110.042 175.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -87.0 29.84 0.8 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.3 -0.864 . . . . 1.2 112.223 -172.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 30.4 t70 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.611 -0.709 . . . . 2.7200000000000002 109.929 177.108 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 112.0 -0.44 . . . . 19.890000000000001 112.0 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 22.2 t -129.47 80.02 72.79 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-O 120.995 0.426 . . . . 18.329999999999998 110.867 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -87.32 176.26 4.34 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.806 2.337 . . . . 17.390000000000001 111.47 175.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -86.22 0.3 87.24 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.893 -0.67 . . . . 16.359999999999999 111.719 177.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 57.61 72.77 0.85 Allowed Pre-proline 0 C--N 1.331 -0.219 0 C-N-CA 123.265 0.626 . . . . 16.0 111.53 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.83 -39.13 11.97 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.312 2.008 . . . . 13.15 111.398 175.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -105.57 -45.81 4.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.936 -0.575 . . . . 12.359999999999999 109.858 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 144.01 -144.47 13.54 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.765 -0.731 . . . . 9.6300000000000008 112.466 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 7.9 tt -134.45 96.72 3.64 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.634 -0.506 . . . . 8.3399999999999999 109.634 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 528' ' ' LEU . . . . . 0.414 HD13 ' NE2' ' A' ' 85' ' ' GLN . 45.8 tp -113.49 9.59 18.07 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.882 -0.784 . . . . 10.41 108.882 174.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 7.9 p -166.23 56.56 0.1 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.195 -0.911 . . . . 7.6200000000000001 110.658 -176.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -124.51 -97.26 1.18 Allowed Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.61 -0.805 . . . . 5.1900000000000004 112.076 -177.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -127.36 14.43 7.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.035 0.445 . . . . 5.5 110.426 -178.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 532' ' ' GLU . . . . . 0.512 ' HA ' ' OG ' ' B' ' 535' ' ' SER . 4.8 mm-40 -105.66 15.85 26.26 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.748 0.785 . . . . 5.6799999999999997 111.158 -177.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -76.92 -57.94 3.56 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.768 -1.106 . . . . 3.2200000000000002 111.061 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -66.77 -24.61 66.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.417 0.627 . . . . 4.2699999999999996 110.685 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 535' ' ' SER . . . . . 0.574 ' HA ' ' HB3' ' B' ' 538' ' ' ALA . 3.9 p -81.48 -4.05 54.78 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.561 -0.745 . . . . 1.25 110.619 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 536' ' ' SER . . . . . 0.408 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 22.9 t -77.64 -25.54 49.75 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.031 -0.729 . . . . 2.0800000000000001 109.031 171.227 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 40.9 mm -84.83 -31.22 7.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 109.282 -0.636 . . . . 1.29 109.282 171.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 538' ' ' ALA . . . . . 0.574 ' HB3' ' HA ' ' B' ' 535' ' ' SER . . . -75.95 2.49 12.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.778 0.799 . . . . 0.76000000000000001 110.103 172.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' B' ' 536' ' ' SER . 23.7 t0 -82.35 -41.55 19.88 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.923 -1.035 . . . . 1.23 108.333 170.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 81.4 mmm -60.26 -33.82 72.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.434 -1.257 . . . . 2.29 109.624 172.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -57.23 -57.16 13.8 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.436 -0.802 . . . . 1.1799999999999999 109.966 174.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.492 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -60.42 -40.95 92.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.116 -0.947 . . . . 0.56000000000000005 111.558 -176.048 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 36.6 m -61.27 -37.27 82.52 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.903 -0.59 . . . . 1.5800000000000001 111.441 -178.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 544' ' ' ALA . . . . . 0.411 ' O ' ' HG2' ' B' ' 548' ' ' GLN . . . -78.88 -28.15 44.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.215 0.531 . . . . 0.83999999999999997 110.215 176.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.427 HD21 ' HB3' ' A' ' 55' ' ' SER . 58.4 tp -71.57 -49.59 39.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.138 -0.937 . . . . 1.0800000000000001 111.643 -177.118 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 8.5 mt -70.06 -25.51 63.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.365 0.602 . . . . 0.96999999999999997 109.791 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 18.3 t -70.73 -15.28 62.68 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.073 -0.967 . . . . 1.4199999999999999 110.503 177.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 548' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' B' ' 544' ' ' ALA . 16.2 mm100 -68.13 -37.08 80.69 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.517 0.675 . . . . 2.6699999999999999 110.537 177.221 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 51.3 mt -92.51 -43.02 13.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 CA-C-N 114.798 -1.092 . . . . 5.2300000000000004 110.193 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 22.2 t -82.19 82.52 7.69 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.783 -0.644 . . . . 6.4000000000000004 110.303 -179.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.339 -0.839 . . . . 7.5899999999999999 110.081 176.684 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo . . . . . 0 N--CA 1.474 0.366 0 N-CA-C 110.645 -0.56 . . . . 1.8899999999999999 110.645 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.2 m -72.81 116.83 13.78 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.418 0.627 . . . . 2.0499999999999998 110.716 -176.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.515 ' HA ' HD12 ' A' ' 18' ' ' ILE . 41.7 m80 -92.21 11.57 25.22 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.387 -0.824 . . . . 0.75 109.704 176.159 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.8 p -158.29 164.68 36.18 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 119.749 -0.78 . . . . 1.0900000000000001 112.648 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.444 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 176.76 -163.75 32.91 Favored Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 114.692 -1.14 . . . . 0.16 110.916 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.83 135.72 43.97 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.677 -0.49 . . . . 0.16 109.677 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.508 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -148.54 143.01 26.36 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.039 0.447 . . . . 0.11 111.756 -175.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 13' ' ' SER . 89.1 mt -106.63 124.21 62.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.22 -0.446 . . . . 0.33000000000000002 110.226 177.102 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -127.35 140.75 51.98 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 108.682 -0.858 . . . . 0.35999999999999999 108.682 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 54.36 25.62 6.16 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.636 0.375 . . . . 0.80000000000000004 111.113 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm 65.49 14.44 9.47 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.801 0.667 . . . . 2.1099999999999999 112.801 -177.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.441 HG13 ' CH2' ' A' ' 29' ' ' TRP . 2.1 p -103.97 121.72 55.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 108.428 -0.953 . . . . 0.22 108.428 166.032 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.489 ' HA ' HG12 ' A' ' 8' ' ' ILE . 50.1 p -75.49 144.38 42.05 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.379 -0.373 . . . . 1.0700000000000001 110.85 -175.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.438 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.96 -160.01 10.64 Favored Glycine 0 N--CA 1.437 -1.243 0 C-N-CA 120.256 -0.973 . . . . 0.11 113.527 -177.293 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.7 mm -126.12 132.19 70.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 109.296 -0.631 . . . . 0.13 109.296 -177.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.553 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.37 136.39 34.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 120.684 0.278 . . . . 0.13 110.477 -175.664 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.24 127.26 25.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.92 0.391 . . . . 0.10000000000000001 111.76 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.515 HD12 ' HA ' ' A' ' 3' ' ' HIS . 57.8 mt -86.11 135.51 24.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.757 -0.461 . . . . 0.27000000000000002 109.757 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -110.32 106.72 16.2 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.164 -0.471 . . . . 1.24 110.989 -175.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.442 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 30.4 mt-10 -117.35 170.25 8.86 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.848 -0.797 . . . . 1.2 108.848 174.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.442 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 34.6 t70 78.04 -3.98 2.28 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 122.342 1.068 . . . . 0.57999999999999996 109.737 -176.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' ' 23' ' ' SER . 32.9 m -103.09 -174.07 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-N 113.96 -1.473 . . . . 0.25 109.651 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.598 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.8 m -72.35 164.66 57.78 Favored Pre-proline 0 C--N 1.316 -0.868 0 N-CA-C 104.997 -2.223 . . . . 1.1299999999999999 104.997 174.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.408 ' O ' HG13 ' A' ' 41' ' ' VAL . 82.2 Cg_exo -41.45 128.79 3.46 Favored 'Trans proline' 0 C--N 1.353 0.785 0 CA-C-N 120.949 1.374 . . . . 0.16 112.744 -141.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -47.66 141.3 5.46 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 113.919 -1.491 . . . . 0.10000000000000001 112.703 -165.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -127.71 164.7 21.54 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 114.382 -1.281 . . . . 0.32000000000000001 111.731 -169.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.719 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -115.48 105.44 12.81 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 107.55 -1.278 . . . . 0.089999999999999997 107.55 173.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.0 m -100.39 106.71 18.33 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 120.941 0.4 . . . . 0.17000000000000001 110.57 -176.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.441 ' CH2' HG13 ' A' ' 12' ' ' VAL . 82.7 t90 -84.67 131.72 34.55 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.801 -0.815 . . . . 0.14000000000000001 108.801 172.573 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.561 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 36.8 mtm180 -122.66 160.86 24.93 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.824 -0.806 . . . . 1.9099999999999999 108.824 175.455 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -72.38 178.1 4.18 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.995 -0.743 . . . . 0.59999999999999998 108.995 175.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.438 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 5.1 p -60.43 -31.25 70.23 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.307 -0.557 . . . . 0.26000000000000001 111.046 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -94.6 -24.27 17.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.785 0.802 . . . . 2.1200000000000001 109.686 172.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.561 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 88.32 16.76 58.48 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 114.762 -1.108 . . . . 0.23000000000000001 111.591 -178.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -65.69 -41.43 92.39 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.052 -0.722 . . . . 1.73 109.052 175.285 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.6 tttt -91.98 140.86 29.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.03 -0.987 . . . . 1.3 108.361 171.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.482 HG23 ' HG2' ' A' ' 30' ' ' ARG . 11.1 p -148.48 135.96 13.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.812 0.339 . . . . 0.17000000000000001 110.639 -178.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -143.65 124.99 14.65 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.966 -0.383 . . . . 0.40999999999999998 109.966 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.3 m -110.81 141.14 44.55 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.144 0.424 . . . . 0.14999999999999999 112.144 -173.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.719 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -111.09 129.22 66.76 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 N-CA-C 108.037 -1.097 . . . . 0.12 108.037 168.163 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.46 ' O ' HG12 ' A' ' 45' ' ' ILE . 94.3 t -93.01 121.41 43.68 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 O-C-N 120.991 -1.068 . . . . 0.11 108.973 173.347 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.572 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -68.75 -21.22 64.38 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.098 0.777 . . . . 0.080000000000000002 113.098 -169.319 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 p -68.23 -15.98 63.79 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.383 0.611 . . . . 0.87 109.386 175.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.482 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 5.1 p -111.18 14.29 21.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.395 -0.82 . . . . 0.14999999999999999 110.079 -178.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.559 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.3 mm -112.41 139.05 39.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.961 -0.755 . . . . 0.12 108.961 177.182 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -105.23 -43.84 4.91 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.181 -0.463 . . . . 0.52000000000000002 110.586 -175.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 26.7 mtpt -133.07 169.09 17.34 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 121.334 0.588 . . . . 1.4099999999999999 111.292 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.898 HD11 HD12 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -150.77 146.34 26.33 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.909 -1.041 . . . . 0.72999999999999998 108.998 176.57 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.681 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 11.6 mm-40 -134.5 145.23 48.59 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.979 -0.378 . . . . 1.9399999999999999 109.979 -173.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.593 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -142.12 132.69 25.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 118.135 0.425 . . . . 0.22 111.032 174.136 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.46 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 82.6 p -64.98 118.03 45.03 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.508 -0.769 . . . . 0.26000000000000001 110.704 -176.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -54.86 160.23 7.99 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 123.057 2.505 . . . . 0.38 112.34 177.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.03 -12.87 61.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.06 -0.518 . . . . 0.66000000000000003 111.438 -178.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.9 m -89.16 -19.23 25.73 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.219 0.533 . . . . 1.5 110.558 174.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.9 m -72.57 141.3 48.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.553 -0.749 . . . . 0.84999999999999998 111.005 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.5 -6.42 19.55 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.408 -0.815 . . . . 1.77 111.151 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.425 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 9.0 mptt -107.65 159.81 16.18 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.957 -1.02 . . . . 1.6299999999999999 111.716 -175.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.46 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 3.1 mtp -131.91 98.3 4.41 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 114.636 -1.165 . . . . 1.1100000000000001 108.778 168.657 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.446 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.1 OUTLIER -154.89 155.36 34.19 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.727 -0.67 . . . . 0.22 112.15 -172.364 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.511 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -135.11 119.05 17.36 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.659 -1.155 . . . . 0.10000000000000001 108.302 177.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.7 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 6.4 mtp180 -104.25 138.04 41.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.232 0.539 . . . . 2.9900000000000002 111.171 -178.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.922 HD21 HD13 ' A' ' 104' ' ' LEU . 1.6 mm? -115.9 106.02 13.34 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.34 -0.845 . . . . 0.13 109.252 176.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.545 HG13 ' HG2' ' A' ' 86' ' ' ARG . 3.0 mp -88.67 108.33 18.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 110.318 -0.253 . . . . 0.28999999999999998 110.318 -173.6 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.587 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -63.58 157.82 40.81 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.135 -0.555 . . . . 0.54000000000000004 112.659 179.14 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 82.8 mttt -75.52 147.14 39.98 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.018 0.437 . . . . 0.55000000000000004 111.184 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.525 ' CG2' ' HG3' ' A' ' 84' ' ' PRO . 1.7 t -101.28 141.87 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-N 115.782 -0.644 . . . . 1.73 111.13 -175.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.446 ' HB2' ' HD2' ' A' ' 70' ' ' LYS . 23.8 m-20 -107.18 81.8 1.59 Allowed 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.156 -1.053 . . . . 3.23 108.156 167.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -70.26 -2.84 14.56 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.249 0.547 . . . . 2.3900000000000001 111.044 -174.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.3 p -91.37 -3.72 56.46 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.621 -0.718 . . . . 2.96 110.601 173.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 8.5 ptmm? -83.19 27.89 0.55 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.206 -0.452 . . . . 2.4900000000000002 110.459 -177.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.544 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 29.3 mmtm -44.86 113.38 0.55 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.542 -0.754 . . . . 3.3999999999999999 110.94 -170.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.527 ' HB3' HG23 ' A' ' 80' ' ' VAL . 72.3 ttt180 -98.04 165.93 11.67 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 108.174 -1.047 . . . . 3.7999999999999998 108.174 178.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.595 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 63.1 mttp -134.01 140.83 46.96 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.704 -0.48 . . . . 4.29 109.704 172.57 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.479 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.5 OUTLIER -79.09 -172.07 2.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.642 -0.708 . . . . 4.4100000000000001 110.057 -178.237 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -62.15 -31.84 72.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.616 0.246 . . . . 5.3399999999999999 111.327 -179.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.479 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 26.0 mt-10 -78.79 -31.53 46.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.701 0.286 . . . . 5.3799999999999999 110.798 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 114.65 17.09 7.16 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.786 -0.721 . . . . 4.3700000000000001 112.635 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.595 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 38.1 m-80 -74.07 134.05 42.92 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.571 -0.529 . . . . 4.5099999999999998 109.571 177.192 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -72.01 91.41 1.22 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.568 -0.53 . . . . 4.2800000000000002 109.568 178.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.535 ' HB ' ' HA ' ' B' ' 525' ' ' ASN . 27.2 m -93.25 100.76 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.902 0 CA-C-O 122.035 0.922 . . . . 3.1000000000000001 109.885 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.544 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.5 p -94.82 106.27 23.75 Favored Pre-proline 0 C--N 1.319 -0.73 0 CA-C-N 115.554 -0.748 . . . . 2.5 109.612 177.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.65 ' HA ' ' O ' ' B' ' 525' ' ' ASN . 36.6 Cg_exo -64.04 143.41 84.67 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 123.366 2.711 . . . . 1.8700000000000001 113.212 -171.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.572 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -87.67 167.79 19.37 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 114.795 -1.093 . . . . 2.7400000000000002 110.331 -177.273 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.587 ' HB3' ' O ' ' A' ' 64' ' ' GLY . 11.3 Cg_exo -58.46 148.28 81.46 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.089 1.86 . . . . 0.83999999999999997 112.837 -178.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -92.32 115.85 28.45 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.492 -0.777 . . . . 1.5700000000000001 109.377 175.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.545 ' HG2' HG13 ' A' ' 63' ' ' ILE . 31.3 mtm-85 -104.67 120.96 42.56 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 114.962 -1.017 . . . . 2.52 110.453 -172.293 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.568 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 38.2 m80 -96.24 110.2 22.54 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.974 -0.75 . . . . 0.71999999999999997 108.974 -176.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.7 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 24.1 ttm -108.27 118.97 38.16 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 119.898 -0.721 . . . . 0.27000000000000002 111.341 -177.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.508 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.3 m-85 -109.53 128.54 55.27 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.2 -0.909 . . . . 0.27000000000000002 109.905 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.473 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.59 151.09 27.83 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 110.038 -0.356 . . . . 1.26 110.038 176.058 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.413 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 20.7 m-85 -130.54 174.43 9.9 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.362 0.601 . . . . 0.32000000000000001 111.69 -173.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -115.42 -19.54 10.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.103 -0.953 . . . . 2.3799999999999999 110.878 177.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.428 ' HB2' HG23 ' A' ' 96' ' ' VAL . 17.3 m120 -142.61 133.56 25.71 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.423 0.63 . . . . 1.1000000000000001 110.926 -178.306 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.504 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.7 mmm180 -61.46 -35.52 77.86 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.713 -1.131 . . . . 3.0899999999999999 112.063 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.9 m -62.85 -34.14 76.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.735 0.302 . . . . 0.34999999999999998 110.775 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.548 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.0 t -69.2 -57.06 9.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.299 -0.41 . . . . 0.23000000000000001 110.328 178.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.511 ' HA ' HD12 ' A' ' 60' ' ' LEU . 12.6 ptp -57.96 -38.69 76.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.056 -0.52 . . . . 0.17000000000000001 111.39 -176.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 97' ' ' MET . 15.6 t70 -67.63 -37.46 82.49 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.996 -0.282 . . . . 0.34000000000000002 110.297 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.481 ' HA ' ' HE2' ' A' ' 102' ' ' MET . 4.2 m-80 -72.56 -43.03 64.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.242 -0.435 . . . . 1.3600000000000001 111.163 178.227 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.655 HG22 HD11 ' A' ' 104' ' ' LEU . 32.4 mm -62.42 -56.62 16.41 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 N-CA-C 108.849 -0.797 . . . . 0.12 108.849 177.247 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.817 ' HA ' HD12 ' A' ' 104' ' ' LEU . 12.3 ttpp -51.34 -46.24 62.6 Favored 'General case' 0 C--O 1.22 -0.481 0 O-C-N 123.693 0.621 . . . . 0.79000000000000004 110.112 177.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.646 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 38.2 ttp -50.3 -59.69 3.72 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.669 -0.696 . . . . 0.28000000000000003 111.175 177.03 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.78 ' O ' HG13 ' A' ' 107' ' ' ILE . 35.5 m -57.39 -52.81 63.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.212 -0.449 . . . . 0.17999999999999999 110.546 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.922 HD13 HD21 ' A' ' 62' ' ' LEU . 26.4 mt -45.8 -55.35 6.7 Favored 'General case' 0 C--O 1.223 -0.336 0 O-C-N 123.685 0.615 . . . . 0.089999999999999997 110.313 174.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.671 ' CG ' HD13 ' A' ' 48' ' ' LEU . 23.7 mt-30 -55.75 -43.93 77.13 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.877 -1.056 . . . . 1.2 112.484 177.247 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.646 ' HG3' ' O ' ' A' ' 102' ' ' MET . 42.2 mt-30 -62.12 -32.43 73.0 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.877 0.846 . . . . 2.3700000000000001 108.862 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.78 HG13 ' O ' ' A' ' 103' ' ' THR . 9.8 mt -78.63 -46.68 24.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 114.284 -1.325 . . . . 0.14999999999999999 111.116 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.898 HD12 HD11 ' A' ' 48' ' ' LEU . 7.9 mt -61.8 -39.52 83.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.074 -0.512 . . . . 0.19 111.675 -177.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.0 t -60.17 -26.82 66.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.653 0.263 . . . . 1.1399999999999999 111.065 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -65.64 -43.82 88.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.537 0.684 . . . . 1.6399999999999999 109.249 174.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.408 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 29.7 m-85 -91.53 12.04 22.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.65000000000000002 109.759 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? -94.53 -40.6 9.79 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.75 -1.113 . . . . 0.76000000000000001 108.118 173.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -77.39 -28.48 52.81 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.802 -1.09 . . . . 2.27 110.39 174.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -101.12 30.76 3.95 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.996 -0.547 . . . . 1.2 111.203 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 20.4 t70 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.269 -0.872 . . . . 2.7200000000000002 109.776 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.661 0 N-CA-C 111.932 -0.467 . . . . 19.890000000000001 111.932 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 50.9 m 53.86 72.24 1.17 Allowed Pre-proline 0 C--O 1.234 0.285 0 CA-C-O 121.213 0.53 . . . . 18.329999999999998 111.424 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -81.63 160.53 19.25 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.871 2.381 . . . . 17.390000000000001 112.045 -178.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -82.11 2.16 84.96 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 111.421 -0.672 . . . . 16.359999999999999 111.421 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 62.58 72.64 0.59 Allowed Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 123.28 0.632 . . . . 16.0 111.327 177.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -87.28 22.09 0.97 Allowed 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.957 2.438 . . . . 13.15 112.02 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 525' ' ' ASN . . . . . 0.65 ' O ' ' HA ' ' A' ' 82' ' ' PRO . 92.1 m-20 -80.43 55.44 2.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.908 -0.587 . . . . 12.359999999999999 110.57 -177.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 98.36 124.0 4.93 Favored Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 111.054 -0.819 . . . . 9.6300000000000008 111.054 -174.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 5.4 tt 67.83 90.96 0.09 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.302 0.572 . . . . 8.3399999999999999 109.518 -174.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 3.0 tt -104.81 77.01 1.31 Allowed 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 108.26 -1.015 . . . . 10.41 108.26 174.473 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 16.0 m 57.33 66.63 1.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.343 -0.844 . . . . 7.6200000000000001 110.703 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -99.98 -99.02 2.25 Favored Glycine 0 N--CA 1.444 -0.827 0 C-N-CA 120.545 -0.836 . . . . 5.1900000000000004 112.394 -177.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -135.43 -11.95 2.11 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.332 0.587 . . . . 5.5 111.062 -176.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -105.39 22.4 15.5 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 122.214 1.007 . . . . 5.6799999999999997 110.218 -178.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.65 -41.52 88.12 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 113.986 -1.461 . . . . 3.2200000000000002 111.736 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -68.96 -37.98 79.12 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.112 0.482 . . . . 4.2699999999999996 110.592 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 3.2 p -76.04 -11.24 59.91 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.745 -0.661 . . . . 1.25 111.146 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 74.6 m -84.61 -37.62 20.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.183 0.516 . . . . 2.0800000000000001 110.432 173.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 537' ' ' ILE . . . . . 0.434 HD13 ' HA ' ' B' ' 537' ' ' ILE . 23.3 mm -74.85 -34.36 33.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.035 0.445 . . . . 1.29 110.155 175.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -78.26 4.37 12.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.249 0.547 . . . . 0.76000000000000001 110.76 175.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.413 ' HB2' ' NH1' ' A' ' 61' ' ' ARG . 28.0 t70 -90.18 -40.41 12.22 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.691 -0.686 . . . . 1.23 109.397 174.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 36.7 mtm -55.95 -32.23 63.67 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 115.171 -0.922 . . . . 2.29 109.857 174.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 541' ' ' ASP . . . . . 0.536 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 3.8 t70 -56.45 -44.16 80.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.716 -1.129 . . . . 1.1799999999999999 110.749 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 542' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -31.89 73.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.588 -0.733 . . . . 0.56000000000000005 112.052 -171.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 10.3 t -64.89 -29.57 70.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.004 0.431 . . . . 1.5800000000000001 110.357 -178.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -91.32 -8.54 47.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.086 -0.506 . . . . 0.83999999999999997 110.838 178.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 78.3 mt -87.8 -37.22 16.77 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.262 -0.426 . . . . 1.0800000000000001 112.018 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 82.8 mt -71.54 -37.71 71.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.463 0.649 . . . . 0.96999999999999997 109.695 177.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 2.9 p -118.21 89.96 3.23 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.949 -1.023 . . . . 1.4199999999999999 109.93 175.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -85.88 64.1 8.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.658 -0.701 . . . . 2.6699999999999999 111.411 -173.1 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 37.9 pt -87.41 -8.5 11.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.944 -0.571 . . . . 5.2300000000000004 110.69 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 48.2 p -98.61 -5.13 32.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.104 0.478 . . . . 6.4000000000000004 110.296 176.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 14.1 m . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.858 -0.592 . . . . 7.5899999999999999 110.139 -179.432 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo . . . . . 0 N--CA 1.479 0.662 0 N-CA-C 110.378 -0.662 . . . . 1.8899999999999999 110.378 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.7 p -92.14 -74.7 0.51 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.457 0.169 . . . . 2.0499999999999998 111.457 -178.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.565 ' HA ' HD12 ' A' ' 18' ' ' ILE . 75.3 m80 62.19 6.83 1.95 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.21 0.604 . . . . 0.75 111.656 -174.095 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 p -158.68 165.86 33.39 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.085 -0.646 . . . . 1.0900000000000001 112.171 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.499 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 175.57 -165.77 36.78 Favored Glycine 0 N--CA 1.44 -1.081 0 CA-C-N 114.971 -1.013 . . . . 0.16 110.915 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.3 134.1 46.13 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 117.153 0.476 . . . . 0.16 110.009 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.583 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -146.56 148.61 32.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.623 -0.262 . . . . 0.11 111.656 -176.071 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.802 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 61.6 mt -109.39 122.83 64.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.952 0.406 . . . . 0.33000000000000002 110.719 176.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.414 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.3 t80 -125.59 134.16 52.02 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.785 -0.82 . . . . 0.35999999999999999 108.785 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 59.52 26.61 15.62 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.777 0.431 . . . . 0.80000000000000004 110.543 -177.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt 69.56 1.06 3.19 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.825 0.85 . . . . 2.1099999999999999 113.125 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.414 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.5 OUTLIER -92.45 123.77 44.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 108.418 -0.956 . . . . 0.22 108.418 167.842 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.3 m -75.9 145.77 40.24 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.901 0.381 . . . . 1.0700000000000001 110.234 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.6 -160.82 11.17 Favored Glycine 0 N--CA 1.437 -1.297 0 C-N-CA 120.317 -0.944 . . . . 0.11 112.944 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.5 mm -125.28 135.04 65.29 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.217 -0.661 . . . . 0.13 109.217 -178.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.595 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -104.08 135.5 41.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 110.133 -0.321 . . . . 0.13 110.133 -175.493 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.69 129.2 30.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.928 0.394 . . . . 0.10000000000000001 111.594 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.565 HD12 ' HA ' ' A' ' 3' ' ' HIS . 58.5 mt -86.11 134.98 26.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 109.812 -0.44 . . . . 0.27000000000000002 109.812 177.589 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -111.33 103.57 11.97 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.245 -0.434 . . . . 1.24 111.303 -173.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.455 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 30.9 mt-10 -114.95 170.32 8.43 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.435 -0.95 . . . . 1.2 108.435 173.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.455 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.1 t70 80.77 -5.84 1.69 Allowed 'General case' 0 N--CA 1.484 1.225 0 CA-C-O 122.393 1.092 . . . . 0.57999999999999996 109.472 -176.669 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 23' ' ' SER . 26.4 m -102.74 -173.18 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-N 113.732 -1.576 . . . . 0.25 109.107 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.627 ' O ' HG23 ' A' ' 22' ' ' VAL . 30.5 m -72.15 168.12 25.95 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 105.549 -2.019 . . . . 1.1299999999999999 105.549 175.146 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.411 ' O ' HG13 ' A' ' 41' ' ' VAL . 68.8 Cg_exo -40.76 128.36 2.64 Favored 'Trans proline' 0 C--N 1.359 1.095 0 CA-C-N 121.288 1.496 . . . . 0.16 112.518 -145.243 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.517 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -49.24 140.39 9.9 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 114.215 -1.357 . . . . 0.10000000000000001 112.534 -164.042 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.29 166.47 15.84 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.353 -1.294 . . . . 0.32000000000000001 111.862 -170.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.768 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -115.84 107.3 14.85 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 107.633 -1.247 . . . . 0.089999999999999997 107.633 173.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.1 m -104.16 106.94 17.62 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 120.82 0.343 . . . . 0.17000000000000001 111.301 -174.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 86.2 t90 -85.21 130.44 34.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.942 -0.762 . . . . 0.14000000000000001 108.942 172.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.454 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 61.4 mtt180 -125.16 156.7 37.98 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 108.77 -0.826 . . . . 1.9099999999999999 108.77 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -66.0 174.47 2.47 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.301 -0.629 . . . . 0.59999999999999998 109.301 178.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.1 p -58.02 -36.92 73.38 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.408 -0.517 . . . . 0.26000000000000001 110.681 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -87.67 -32.26 19.32 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.558 0.694 . . . . 2.1200000000000001 109.716 172.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.454 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 100.29 12.78 37.93 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 114.922 -1.036 . . . . 0.23000000000000001 112.825 176.426 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -66.68 -36.53 82.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.36 0.6 . . . . 1.73 109.895 176.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -95.68 137.82 34.2 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.414 -0.958 . . . . 1.3 108.414 174.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 14.6 p -150.48 136.31 11.54 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-O 120.994 0.426 . . . . 0.17000000000000001 111.391 -177.003 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -143.71 128.8 18.64 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.634 -0.506 . . . . 0.40999999999999998 109.634 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 30.4 m -114.37 140.86 48.31 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.033 0.383 . . . . 0.14999999999999999 112.033 -172.771 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.768 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -107.89 128.97 62.77 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 N-CA-C 108.18 -1.044 . . . . 0.12 108.18 168.383 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 45' ' ' ILE . 99.8 t -92.3 118.78 38.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 121.228 -0.92 . . . . 0.11 108.963 173.507 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.568 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -67.56 -18.55 65.05 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.866 0.691 . . . . 0.080000000000000002 112.866 -170.404 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.537 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 80.4 p -68.18 -18.3 64.56 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.177 -0.675 . . . . 0.87 109.177 176.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.9 p -109.99 13.21 23.45 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.886 -1.052 . . . . 0.14999999999999999 110.206 -177.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.554 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 27.4 mm -111.63 140.47 30.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.054 -0.521 . . . . 0.12 109.657 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -106.86 -43.99 4.54 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.882 -0.599 . . . . 0.52000000000000002 110.839 -175.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.537 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 40.4 mtpt -133.57 172.26 12.98 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.411 0.624 . . . . 1.4099999999999999 111.537 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.657 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -151.08 148.95 28.94 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.939 -1.028 . . . . 0.72999999999999998 108.882 174.8 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.515 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 5.4 mm-40 -136.34 153.36 51.16 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.381 -0.6 . . . . 1.9399999999999999 109.381 -176.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.463 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -145.66 140.36 27.24 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 118.278 0.49 . . . . 0.22 110.917 176.243 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 76.2 p -71.08 118.21 63.56 Favored Pre-proline 0 C--O 1.234 0.258 0 CA-C-N 116.134 -0.485 . . . . 0.26000000000000001 111.272 -176.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.466 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 17.4 Cg_exo -56.82 160.69 11.62 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.867 2.378 . . . . 0.38 112.299 177.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.56 -20.88 66.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.697 -0.683 . . . . 0.66000000000000003 111.871 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.8 m -85.9 -18.07 33.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.203 0.525 . . . . 1.5 111.067 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.466 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 35.1 m -68.93 143.34 54.48 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.527 -0.76 . . . . 0.84999999999999998 112.263 -177.342 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -58.18 -26.76 63.15 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 114.639 -1.164 . . . . 1.77 110.975 171.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.518 ' HB3' ' HE1' ' A' ' 59' ' ' MET . 68.1 mmtt -91.73 153.05 19.89 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.948 -1.478 . . . . 1.6299999999999999 111.984 -169.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.577 ' O ' ' HG3' ' A' ' 59' ' ' MET . 80.0 mmm -127.16 96.16 4.51 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.317 -0.994 . . . . 1.1100000000000001 108.317 167.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.577 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -158.52 158.34 33.83 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.581 0.705 . . . . 0.22 112.226 -173.326 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.536 HD12 ' HA ' ' A' ' 97' ' ' MET . 2.4 tt -135.43 120.62 18.91 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.662 -1.154 . . . . 0.10000000000000001 108.121 176.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.624 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 1.0 OUTLIER -102.94 146.34 28.47 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.307 0.575 . . . . 2.9900000000000002 111.591 -177.697 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.938 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -125.62 106.18 9.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.847 -1.07 . . . . 0.13 108.952 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.537 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.4 mp -87.73 105.85 15.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-O 120.695 0.283 . . . . 0.28999999999999998 110.532 -172.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.524 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -74.89 147.66 36.93 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.306 -0.474 . . . . 0.54000000000000004 113.062 -177.136 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.554 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 90.1 mttt -66.98 127.62 33.24 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 122.922 0.489 . . . . 0.55000000000000004 111.945 -178.228 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.655 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.6 t -120.23 142.1 37.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.792 -0.64 . . . . 1.73 110.658 177.129 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.617 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 4.7 m-20 -86.46 82.6 7.89 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.835 -0.802 . . . . 3.23 108.835 175.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.69 -6.34 7.65 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.328 0.492 . . . . 2.3900000000000001 112.328 -172.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.0 p -69.39 -8.45 46.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.387 0.613 . . . . 2.96 110.106 172.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.617 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.2 ptpt -82.92 33.21 0.43 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.489 -0.778 . . . . 2.4900000000000002 111.226 178.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.1 mtmm -46.63 114.21 0.78 Allowed 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.277 -0.638 . . . . 3.3999999999999999 109.277 -177.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.51 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.8 ttt180 -96.65 161.55 13.84 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.012 -0.994 . . . . 3.7999999999999998 109.005 -168.199 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.57 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 98.8 mttt -129.23 146.56 51.11 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 109.669 -0.493 . . . . 4.29 109.669 173.492 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.476 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 1.1 p-10 -81.48 -168.85 2.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.993 -0.549 . . . . 4.4100000000000001 110.52 -177.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -59.37 -32.04 69.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.665 -0.243 . . . . 5.3399999999999999 111.629 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.476 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 16.5 mt-10 -82.67 -41.51 19.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.093 0.473 . . . . 5.3799999999999999 110.648 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 127.12 16.0 2.45 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.737 -0.744 . . . . 4.3700000000000001 112.145 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.57 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 37.1 m-80 -73.11 138.18 45.65 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.63 -0.507 . . . . 4.5099999999999998 109.63 178.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -75.14 93.32 2.77 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.203 -0.453 . . . . 4.2800000000000002 110.401 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.51 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 14.7 m -103.91 99.45 8.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.466 0.65 . . . . 3.1000000000000001 109.309 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.471 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 p -92.41 111.84 52.49 Favored Pre-proline 0 C--N 1.316 -0.889 0 CA-C-O 121.366 0.603 . . . . 2.5 110.655 -177.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 39.1 Cg_exo -62.39 132.81 40.02 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 123.114 2.543 . . . . 1.8700000000000001 112.082 -178.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.438 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 48.0 mtmt -94.02 161.55 29.46 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 115.174 -0.921 . . . . 2.7400000000000002 109.655 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.655 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 32.4 Cg_exo -48.24 146.09 10.28 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.55 2.167 . . . . 0.83999999999999997 112.323 179.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -90.04 115.85 27.63 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.491 -0.777 . . . . 1.5700000000000001 109.891 -173.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.524 ' HG2' HG13 ' A' ' 63' ' ' ILE . 62.5 mtt180 -98.99 126.48 44.7 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 115.237 -0.892 . . . . 2.52 110.963 -171.189 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.515 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 65.1 m80 -94.55 147.54 23.17 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 107.217 -1.401 . . . . 0.71999999999999997 107.217 177.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.624 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 26.6 ttm -141.94 131.84 24.41 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 119.033 0.833 . . . . 0.27000000000000002 111.204 175.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.529 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.5 m-85 -120.97 134.64 55.3 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.471 -0.786 . . . . 0.27000000000000002 109.529 178.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.802 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -79.99 159.39 26.27 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.507 -0.553 . . . . 1.26 109.507 178.071 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 16.7 m-85 -138.4 175.16 9.81 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.349 0.595 . . . . 0.32000000000000001 112.151 -177.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.1 p-10 -116.94 -20.55 9.34 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.111 -0.95 . . . . 2.3799999999999999 110.843 178.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -145.87 143.77 29.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.91 0.385 . . . . 1.1000000000000001 110.451 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.544 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.2 OUTLIER -73.84 -28.56 61.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.831 -0.622 . . . . 3.0899999999999999 111.835 -176.739 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.3 m -63.9 -38.53 91.41 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.757 0.313 . . . . 0.34999999999999998 110.823 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.2 t -63.55 -56.85 14.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.324 -0.398 . . . . 0.23000000000000001 110.273 178.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.544 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 15.7 ptp -58.58 -39.54 80.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.834 -0.621 . . . . 0.17000000000000001 111.21 -176.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.7 -41.0 98.9 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 120.675 -0.41 . . . . 0.34000000000000002 110.331 177.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -71.17 -39.29 71.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.271 -0.422 . . . . 1.3600000000000001 111.71 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.638 HG22 HD11 ' A' ' 104' ' ' LEU . 34.2 mm -64.99 -56.2 16.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 108.858 -0.793 . . . . 0.12 108.858 175.603 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.804 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.8 ttpt -51.57 -45.62 63.16 Favored 'General case' 0 C--O 1.223 -0.293 0 O-C-N 123.911 0.757 . . . . 0.79000000000000004 110.232 177.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.486 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 41.3 ttp -51.87 -54.18 32.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.28 -0.873 . . . . 0.28000000000000003 111.099 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.726 ' O ' HG13 ' A' ' 107' ' ' ILE . 24.4 m -62.33 -52.16 64.76 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.179 -0.464 . . . . 0.17999999999999999 110.395 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.938 HD13 HD21 ' A' ' 62' ' ' LEU . 27.0 mt -46.97 -54.5 10.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.737 -0.665 . . . . 0.089999999999999997 110.522 175.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.584 ' CG ' HD13 ' A' ' 48' ' ' LEU . 43.8 mt-30 -52.59 -46.39 66.92 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.826 -1.079 . . . . 1.2 112.239 176.595 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 102' ' ' MET . 13.7 mm100 -64.14 -27.93 69.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.671 0.748 . . . . 2.3700000000000001 110.287 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.726 HG13 ' O ' ' A' ' 103' ' ' THR . 7.2 mt -81.08 -41.05 18.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 114.737 -1.119 . . . . 0.14999999999999999 110.798 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.657 HD12 HD11 ' A' ' 48' ' ' LEU . 6.3 mt -67.29 -38.63 81.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.354 -0.385 . . . . 0.19 111.84 -178.084 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.2 p -59.97 -24.92 64.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.014 0.435 . . . . 1.1399999999999999 111.202 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 -62.25 -52.31 64.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.608 0.718 . . . . 1.6399999999999999 109.55 172.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.567 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 21.5 m-85 -85.7 18.37 2.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.02 -0.991 . . . . 0.65000000000000002 110.472 177.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? -102.78 -41.51 6.17 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 107.842 -1.17 . . . . 0.76000000000000001 107.842 171.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -72.44 -32.86 66.64 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.975 -1.011 . . . . 2.27 109.969 172.143 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -115.71 68.09 0.71 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.466 -0.788 . . . . 1.2 110.431 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.567 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 31.6 t70 . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.463 -0.779 . . . . 2.7200000000000002 110.577 178.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.716 0 N-CA-C 111.992 -0.443 . . . . 19.890000000000001 111.992 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 61.4 m -130.66 88.7 45.84 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-O 120.922 0.392 . . . . 18.329999999999998 110.734 179.082 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -77.99 -21.76 10.6 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.551 2.167 . . . . 17.390000000000001 112.155 177.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 121.68 -166.82 14.42 Favored Glycine 0 N--CA 1.444 -0.818 0 N-CA-C 111.429 -0.668 . . . . 16.359999999999999 111.429 -176.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -110.55 104.04 55.25 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-O 120.706 0.289 . . . . 16.0 110.706 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.11 168.45 21.87 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.578 2.185 . . . . 13.15 112.077 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -97.73 61.83 1.61 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.103 -0.499 . . . . 12.359999999999999 110.747 -179.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -78.32 55.17 4.02 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.844 -0.616 . . . . 9.6300000000000008 112.181 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 9.7 tt -146.58 -43.98 0.19 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.959 0.885 . . . . 8.3399999999999999 109.599 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 97.4 mt -78.67 -4.84 51.06 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 114.136 -1.393 . . . . 10.41 110.451 176.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 20.9 p -141.18 -74.11 0.33 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.367 -0.833 . . . . 7.6200000000000001 110.773 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 164.43 -84.23 0.11 Allowed Glycine 0 CA--C 1.499 -0.934 0 N-CA-C 110.959 -0.857 . . . . 5.1900000000000004 110.959 176.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -146.03 9.53 1.13 Allowed 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.532 -0.834 . . . . 5.5 110.344 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -87.03 -2.47 58.65 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.727 0.775 . . . . 5.6799999999999997 110.993 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -80.9 3.39 22.91 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.615 -1.175 . . . . 3.2200000000000002 110.582 -176.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -63.33 -22.88 67.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.62 0.724 . . . . 4.2699999999999996 109.531 175.578 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 34.7 p -74.7 -21.48 59.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.795 -1.093 . . . . 1.25 110.387 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 536' ' ' SER . . . . . 0.47 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 31.5 t -74.64 -36.53 62.88 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.235 0.54 . . . . 2.0800000000000001 110.137 178.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 31.3 mm -74.63 -41.09 48.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.949 -0.569 . . . . 1.29 110.186 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -74.94 5.58 4.98 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.665 0.745 . . . . 0.76000000000000001 110.512 176.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.524 ' HB2' ' NH1' ' A' ' 61' ' ' ARG . 34.8 t70 -92.18 -44.96 8.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.117 -0.947 . . . . 1.23 109.653 174.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 33.0 mtm -59.84 -31.96 70.22 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.052 -0.976 . . . . 2.29 109.491 174.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -51.41 -48.24 62.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.593 -1.185 . . . . 1.1799999999999999 110.648 174.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 542' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.52 -35.53 76.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.324 -0.853 . . . . 0.56000000000000005 112.164 -173.15 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 13.3 t -62.5 -46.43 88.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.85 0.357 . . . . 1.5800000000000001 110.804 -175.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -77.35 -21.83 52.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.096 0.474 . . . . 0.83999999999999997 110.255 177.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 18.1 tp -75.6 -37.83 59.53 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.58 -0.736 . . . . 1.0800000000000001 111.2 -175.463 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 85.5 mt -75.68 -25.31 56.62 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.553 0.692 . . . . 0.96999999999999997 109.386 174.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 16.3 m -87.98 31.67 0.78 Allowed 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.974 -1.012 . . . . 1.4199999999999999 110.896 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -91.39 -16.76 26.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.395 0.617 . . . . 2.6699999999999999 110.548 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 1.1 tp -101.25 123.26 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.072 0 CA-C-N 115.344 -0.844 . . . . 5.2300000000000004 110.207 -178.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.8 t 60.42 79.74 0.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.625 -0.716 . . . . 6.4000000000000004 110.96 177.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 69.4 m . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.335 -0.841 . . . . 7.5899999999999999 110.612 178.343 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo . . . . . 0 C--O 1.232 0.202 0 N-CA-C 110.558 -0.593 . . . . 1.8899999999999999 110.558 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 m -64.11 107.79 1.37 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.584 0.707 . . . . 2.0499999999999998 111.794 -174.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.574 ' CD2' HG21 ' A' ' 103' ' ' THR . 56.2 m80 -89.67 8.26 32.46 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.07 -0.968 . . . . 0.75 109.624 171.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.9 p -157.71 168.54 26.93 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.604 -0.839 . . . . 1.0900000000000001 112.785 -176.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.448 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 173.54 -163.43 34.74 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 110.116 -1.194 . . . . 0.16 110.116 -178.339 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -100.29 135.66 41.38 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 117.513 0.657 . . . . 0.16 110.167 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -145.43 152.27 39.56 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.42 -0.355 . . . . 0.11 110.859 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.41 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 79.0 mt -111.7 122.21 65.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.446 -0.343 . . . . 0.33000000000000002 110.465 178.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.505 ' O ' HG13 ' A' ' 12' ' ' VAL . 32.4 t80 -126.17 132.6 51.78 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.218 -0.66 . . . . 0.35999999999999999 109.218 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 58.98 28.16 17.3 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.037 0.535 . . . . 0.80000000000000004 110.328 -176.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt 69.34 0.77 3.01 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.015 0.746 . . . . 2.1099999999999999 113.015 178.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -91.45 121.69 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 108.047 -1.094 . . . . 0.22 108.047 167.077 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.7 m -75.61 145.22 41.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.095 -0.502 . . . . 1.0700000000000001 110.21 -177.005 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.33 -156.81 8.46 Favored Glycine 0 N--CA 1.436 -1.363 0 C-N-CA 120.078 -1.058 . . . . 0.11 113.482 -177.267 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 15.8 mm -125.44 132.31 71.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 C-N-CA 123.217 0.607 . . . . 0.13 109.429 -177.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.572 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.73 135.96 38.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.704 -0.48 . . . . 0.13 109.704 -177.483 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.87 130.87 32.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.808 0.337 . . . . 0.10000000000000001 111.264 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.513 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 52.8 mt -86.16 138.12 19.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 109.685 -0.487 . . . . 0.27000000000000002 109.685 177.128 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -111.22 103.16 11.55 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.137 -0.483 . . . . 1.24 111.091 -174.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 31.1 mt-10 -115.94 170.36 8.54 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.163 -0.68 . . . . 1.2 109.163 175.555 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 26.5 t70 77.26 -3.28 2.49 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.37 1.081 . . . . 0.57999999999999996 109.583 -178.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 23' ' ' SER . 32.8 m -103.0 -173.92 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.046 0 CA-C-N 113.885 -1.507 . . . . 0.25 109.798 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.625 ' O ' HG23 ' A' ' 22' ' ' VAL . 53.6 m -73.01 166.52 42.72 Favored Pre-proline 0 C--N 1.315 -0.896 0 N-CA-C 105.211 -2.144 . . . . 1.1299999999999999 105.211 173.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -41.34 128.52 3.26 Favored 'Trans proline' 0 C--N 1.355 0.902 0 CA-C-N 121.037 1.406 . . . . 0.16 112.738 -141.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.498 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -50.21 142.18 10.26 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 114.105 -1.407 . . . . 0.10000000000000001 112.593 -165.317 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -127.74 169.4 13.89 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 114.447 -1.251 . . . . 0.32000000000000001 111.985 -168.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -120.46 107.25 12.66 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 107.939 -1.134 . . . . 0.089999999999999997 107.939 174.569 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.8 m -101.42 108.53 20.16 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 116.427 -0.351 . . . . 0.17000000000000001 111.193 -175.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.494 ' HH2' ' HG ' ' A' ' 31' ' ' SER . 87.8 t90 -85.3 131.13 34.46 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.853 -0.795 . . . . 0.14000000000000001 108.853 170.058 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.545 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 89.1 mtt180 -122.26 151.12 41.41 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.628 -0.878 . . . . 1.9099999999999999 108.628 172.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.672 ' OG ' ' HB3' ' A' ' 36' ' ' LYS . 2.8 m -61.99 172.49 1.36 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.16 -0.311 . . . . 0.59999999999999998 110.16 173.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.46 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.1 p -60.02 -36.13 76.58 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.218 -0.593 . . . . 0.26000000000000001 110.62 178.554 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -86.17 -14.68 43.33 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.397 -0.594 . . . . 2.1200000000000001 109.397 175.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.545 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 76.99 19.51 77.35 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.147 -0.933 . . . . 0.23000000000000001 112.513 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -84.37 -35.43 23.19 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.533 -0.914 . . . . 1.73 108.533 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.672 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 43.7 tttp -90.68 141.09 29.15 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.18 -1.373 . . . . 1.3 108.59 172.269 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.491 HG23 ' HG2' ' A' ' 30' ' ' ARG . 9.5 p -150.28 138.56 14.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 C-N-CA 120.834 -0.346 . . . . 0.17000000000000001 111.066 -176.519 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -145.07 125.02 13.48 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.973 -0.38 . . . . 0.40999999999999998 109.973 175.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 31.7 m -110.67 137.11 48.76 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.104 0.409 . . . . 0.14999999999999999 112.104 -174.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.37 129.53 56.58 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 N-CA-C 108.117 -1.068 . . . . 0.12 108.117 168.636 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.9 t -93.15 121.66 44.02 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 O-C-N 121.23 -0.919 . . . . 0.11 108.926 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.592 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -68.71 -18.56 64.27 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.104 0.779 . . . . 0.080000000000000002 113.104 -169.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.7 p -72.0 -11.93 61.0 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.066 -0.654 . . . . 0.87 109.75 175.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.2 p -111.31 13.07 21.66 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.345 -0.843 . . . . 0.14999999999999999 109.624 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.553 HG21 HD13 ' A' ' 62' ' ' LEU . 26.8 mm -113.75 138.04 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-N 115.712 -0.676 . . . . 0.12 109.25 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -101.75 -42.56 6.13 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.094 -0.503 . . . . 0.52000000000000002 110.456 -177.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.4 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 15.0 mtmm -142.17 172.7 12.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.306 -0.407 . . . . 1.4099999999999999 111.012 -176.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.844 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -151.01 149.04 29.09 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.591 -0.892 . . . . 0.72999999999999998 108.591 179.739 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.463 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 16.5 mm-40 -138.64 127.76 24.09 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 110.453 -0.203 . . . . 1.9399999999999999 110.453 -175.267 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.587 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -122.01 134.85 54.8 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.452 -0.78 . . . . 0.22 110.968 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.458 ' HB ' ' OG ' ' A' ' 55' ' ' SER . 69.1 p -63.37 115.39 17.71 Favored Pre-proline 0 C--O 1.234 0.247 0 CA-C-N 115.913 -0.585 . . . . 0.26000000000000001 110.409 -175.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 2.2 Cg_endo -54.98 158.95 10.31 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.953 2.436 . . . . 0.38 112.046 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.94 -11.76 49.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.273 -0.421 . . . . 0.66000000000000003 111.382 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.0 t -109.4 25.9 11.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.24 0.543 . . . . 1.5 110.358 176.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.555 ' HB2' HD13 ' B' ' 545' ' ' LEU . 83.9 p -99.98 158.83 15.54 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.746 -0.464 . . . . 0.84999999999999998 109.746 176.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -82.84 12.68 4.55 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 121.298 0.571 . . . . 1.77 110.516 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.523 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 42.9 mmtm -130.6 162.97 28.16 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.539 -0.755 . . . . 1.6299999999999999 111.271 -171.586 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.438 ' O ' ' HG3' ' A' ' 59' ' ' MET . 3.5 mtp -136.9 97.95 3.65 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.997 -1.001 . . . . 1.1100000000000001 108.826 167.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.523 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -156.81 155.13 31.01 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.556 -0.747 . . . . 0.22 111.41 -171.557 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.596 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -131.94 119.03 20.57 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.383 -0.969 . . . . 0.10000000000000001 108.383 176.269 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.612 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 6.9 mtp180 -102.82 146.04 28.87 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 121.423 0.63 . . . . 2.9900000000000002 111.325 -179.011 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.941 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -125.63 104.72 8.53 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 114.524 -1.216 . . . . 0.13 108.787 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.532 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.0 mp -85.66 102.3 11.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.724 0.297 . . . . 0.28999999999999998 110.315 -172.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -63.94 152.96 48.18 Favored Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 115.854 -0.612 . . . . 0.54000000000000004 112.455 178.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 76.8 mttt -75.5 115.25 14.97 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 121.436 0.636 . . . . 0.55000000000000004 112.509 -175.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.694 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 3.9 t -123.15 137.76 55.45 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.14 0 CA-C-N 114.98 -1.009 . . . . 1.73 110.1 172.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 34.4 m-20 -99.24 91.47 4.98 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 108.359 -0.978 . . . . 3.23 108.359 173.119 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 82' ' ' PRO . 46.2 mt-10 -64.86 -1.18 1.82 Allowed 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 112.651 0.611 . . . . 2.3900000000000001 112.651 -171.409 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.3 p -72.75 -9.18 58.35 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.401 0.62 . . . . 2.96 109.94 168.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.603 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 11.6 ptmm? -80.03 41.79 0.53 Allowed 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.261 -0.882 . . . . 2.4900000000000002 111.051 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.418 ' HE2' ' OE1' ' A' ' 79' ' ' GLU . 18.9 mttp -43.41 117.39 1.11 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.562 -0.744 . . . . 3.3999999999999999 111.411 -175.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.566 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 25.7 ttt180 -101.47 158.87 15.75 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.15 -0.932 . . . . 3.7999999999999998 109.118 -175.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 94.1 mttt -131.54 146.67 52.33 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.361 -0.607 . . . . 4.29 109.361 171.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.466 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER -76.62 -174.33 2.92 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.194 -0.457 . . . . 4.4100000000000001 110.229 -178.902 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -56.65 -32.94 65.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 111.801 0.297 . . . . 5.3399999999999999 111.801 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.466 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 21.5 mt-10 -81.02 -46.52 14.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.833 0.349 . . . . 5.3799999999999999 110.823 -178.331 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.01 13.66 1.17 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.669 -0.776 . . . . 4.3700000000000001 112.494 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 37.8 m-80 -71.1 129.01 37.85 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.402 -0.592 . . . . 4.5099999999999998 109.402 177.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.418 ' OE1' ' HE2' ' A' ' 71' ' ' LYS . 35.4 tt0 -70.05 101.85 1.91 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.099 0.476 . . . . 4.2800000000000002 110.083 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.566 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 10.1 m -113.88 98.76 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 CA-C-O 121.818 0.818 . . . . 3.1000000000000001 109.017 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.448 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.5 OUTLIER -87.74 112.64 50.09 Favored Pre-proline 0 C--N 1.311 -1.104 0 CA-C-N 115.762 -0.653 . . . . 2.5 110.035 -177.846 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.481 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 31.7 Cg_exo -63.39 132.52 36.23 Favored 'Trans proline' 0 CA--C 1.511 -0.628 0 C-N-CA 123.152 2.568 . . . . 1.8700000000000001 112.636 -176.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -91.82 162.16 31.8 Favored Pre-proline 0 C--N 1.311 -1.082 0 CA-C-N 114.779 -1.1 . . . . 2.7400000000000002 108.244 174.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.694 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 36.8 Cg_exo -55.89 147.39 62.74 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 121.944 1.763 . . . . 0.83999999999999997 111.772 179.339 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -90.16 114.22 26.14 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-O 121.706 0.765 . . . . 1.5700000000000001 109.137 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.438 ' HG2' HG13 ' A' ' 63' ' ' ILE . 94.0 mtt180 -104.89 125.75 51.24 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 114.999 -1.0 . . . . 2.52 110.282 -171.232 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.596 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 75.2 m-70 -94.04 144.8 25.16 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 107.022 -1.473 . . . . 0.71999999999999997 107.022 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.612 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 25.2 ttm -139.99 124.96 18.51 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 119.056 0.844 . . . . 0.27000000000000002 111.047 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.425 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.6 m-85 -113.95 128.72 56.52 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.166 -0.925 . . . . 0.27000000000000002 109.443 178.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.449 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.6 OUTLIER -80.99 151.59 28.38 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.92 -0.4 . . . . 1.26 109.92 176.771 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.402 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 24.3 m-85 -132.75 173.37 11.43 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.057 0.455 . . . . 0.32000000000000001 110.809 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -124.9 -6.29 7.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.5 -0.773 . . . . 2.3799999999999999 109.424 172.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.412 ' HB2' HG23 ' A' ' 96' ' ' VAL . 49.2 m-80 -136.55 120.4 17.45 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.953 -0.567 . . . . 1.1000000000000001 110.882 -175.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.486 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.0 mmm180 -64.0 -35.58 81.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.344 -0.844 . . . . 3.0899999999999999 111.872 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.2 m -63.17 -36.62 84.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.448 -0.342 . . . . 0.34999999999999998 110.883 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.591 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.5 t -67.1 -57.19 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 CA-C-N 116.47 -0.332 . . . . 0.23000000000000001 110.203 178.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.596 ' HA ' HD12 ' A' ' 60' ' ' LEU . 12.9 ptp -56.59 -37.84 71.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.17000000000000001 111.363 -175.208 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.55 -43.18 85.78 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.602 -0.439 . . . . 0.34000000000000002 110.765 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -69.5 -41.49 76.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.447 -0.342 . . . . 1.3600000000000001 111.471 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.638 HG22 HD11 ' A' ' 104' ' ' LEU . 30.1 mm -62.45 -57.41 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 108.685 -0.857 . . . . 0.12 108.685 176.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.823 ' HA ' HD12 ' A' ' 104' ' ' LEU . 23.4 ttpp -50.12 -49.56 51.4 Favored 'General case' 0 C--O 1.218 -0.583 0 O-C-N 123.902 0.751 . . . . 0.79000000000000004 110.164 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.699 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 37.4 ttp -48.76 -59.8 3.25 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 123.961 0.788 . . . . 0.28000000000000003 111.391 177.428 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.782 ' O ' HG13 ' A' ' 107' ' ' ILE . 36.0 m -57.76 -50.46 73.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.304 -0.407 . . . . 0.17999999999999999 110.335 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.941 HD13 HD21 ' A' ' 62' ' ' LEU . 35.3 mt -46.81 -55.77 7.38 Favored 'General case' 0 C--O 1.221 -0.404 0 O-C-N 123.744 0.652 . . . . 0.089999999999999997 110.278 174.052 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.827 ' HG2' HD13 ' A' ' 48' ' ' LEU . 51.2 mt-30 -54.52 -44.95 73.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.913 -1.04 . . . . 1.2 112.134 177.236 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.699 ' HG3' ' O ' ' A' ' 102' ' ' MET . 85.7 mt-30 -61.82 -31.51 71.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.847 0.832 . . . . 2.3700000000000001 108.956 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.782 HG13 ' O ' ' A' ' 103' ' ' THR . 8.6 mt -80.99 -43.75 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 114.584 -1.189 . . . . 0.14999999999999999 111.163 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.844 HD12 HD11 ' A' ' 48' ' ' LEU . 9.0 mt -63.95 -37.52 80.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.164 -0.471 . . . . 0.19 111.638 -177.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.6 t -55.4 -30.92 61.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.283 -0.417 . . . . 1.1399999999999999 110.782 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -62.47 -41.61 98.89 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.264 0.554 . . . . 1.6399999999999999 109.732 176.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.51 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 23.7 m-85 -97.73 18.73 15.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.701 -0.682 . . . . 0.65000000000000002 109.963 179.107 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.1 -46.78 4.0 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.926 -1.138 . . . . 0.76000000000000001 107.926 176.331 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -75.54 -13.96 60.38 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.577 -1.192 . . . . 2.27 109.993 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -128.88 71.88 1.44 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.424 -0.807 . . . . 1.2 110.195 176.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.51 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 31.3 t70 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.41 -0.805 . . . . 2.7200000000000002 109.968 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 111.431 -0.668 . . . . 19.890000000000001 111.431 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 15.3 t -94.91 121.35 62.86 Favored Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 110.003 -0.369 . . . . 18.329999999999998 110.003 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.23 72.58 4.75 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 123.112 2.541 . . . . 17.390000000000001 112.655 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -179.93 -67.07 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 121.066 -0.588 . . . . 16.359999999999999 111.994 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -140.37 141.09 24.67 Favored Pre-proline 0 C--N 1.323 -0.544 0 N-CA-C 110.048 -0.353 . . . . 16.0 110.048 179.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -78.04 63.24 8.17 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 122.965 2.443 . . . . 13.15 112.815 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -81.28 149.9 28.77 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.019 -0.537 . . . . 12.359999999999999 109.702 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -98.08 92.74 1.29 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.777 -0.725 . . . . 9.6300000000000008 112.611 -176.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.428 ' N ' HD13 ' B' ' 527' ' ' LEU . 0.0 OUTLIER -111.42 29.66 7.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.082 0.467 . . . . 8.3399999999999999 110.856 177.579 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 60.0 tp -75.65 83.72 2.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.895 -0.593 . . . . 10.41 111.305 -175.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 37.0 m 64.23 25.41 13.58 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.544 -0.753 . . . . 7.6200000000000001 112.551 172.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -95.63 -100.79 1.84 Allowed Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.12 -1.038 . . . . 5.1900000000000004 111.694 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -123.81 -28.6 3.8 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.827 0.822 . . . . 5.5 109.719 -178.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 532' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' B' ' 536' ' ' SER . 38.4 mt-10 -79.53 -9.31 59.59 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.662 -1.153 . . . . 5.6799999999999997 109.449 178.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -63.96 -26.39 68.56 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 113.591 -1.641 . . . . 3.2200000000000002 110.94 -177.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -102.07 -60.3 1.56 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.192 0.52 . . . . 4.2699999999999996 111.435 -176.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 20.2 p -74.4 -19.86 60.26 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.621 -0.718 . . . . 1.25 112.753 -170.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 536' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 50.4 m -79.76 -34.38 39.89 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.617 -0.433 . . . . 2.0800000000000001 110.523 175.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 47.6 mm -73.75 -40.83 54.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.331 0.586 . . . . 1.29 109.727 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -78.85 -0.14 29.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.687 0.756 . . . . 0.76000000000000001 110.394 177.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.5 ' HB2' ' NH1' ' A' ' 61' ' ' ARG . 10.7 t70 -86.76 -45.52 10.86 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.957 -1.02 . . . . 1.23 108.869 171.489 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 86.3 mtp -59.48 -34.5 72.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.64 -1.164 . . . . 2.29 110.011 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -57.53 -53.07 62.3 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.988 0.899 . . . . 1.1799999999999999 110.022 173.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.444 ' HA ' HD12 ' B' ' 545' ' ' LEU . 0.2 OUTLIER -65.06 -45.91 83.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.057 -1.428 . . . . 0.56000000000000005 111.727 -171.509 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 14.5 m -56.79 -28.24 61.05 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.982 -0.554 . . . . 1.5800000000000001 112.152 -176.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -82.23 -20.91 36.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.372 -0.376 . . . . 0.83999999999999997 110.929 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.555 HD13 ' HB2' ' A' ' 55' ' ' SER . 89.9 mt -78.86 -33.66 45.68 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.989 -0.55 . . . . 1.0800000000000001 111.532 -176.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -63.16 -70.04 0.23 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.752 0.786 . . . . 0.96999999999999997 110.212 175.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 12.9 p -71.99 59.93 0.38 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.201 -1.363 . . . . 1.4199999999999999 112.251 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -98.48 7.22 46.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.108 0.48 . . . . 2.6699999999999999 109.957 173.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 43.3 mt 61.52 66.75 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 115.208 -0.905 . . . . 5.2300000000000004 109.764 -176.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.4 t -71.42 -39.65 70.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.271 -0.877 . . . . 6.4000000000000004 110.125 -177.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 48.0 m . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.733 -0.651 . . . . 7.5899999999999999 109.941 177.631 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo . . . . . 0 N--CA 1.478 0.595 0 N-CA-C 110.37 -0.666 . . . . 1.8899999999999999 110.37 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.6 t -168.61 -41.14 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.938 0.399 . . . . 2.0499999999999998 110.544 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.402 ' CD2' HG21 ' A' ' 103' ' ' THR . 76.0 m80 66.89 -11.37 0.26 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.696 -0.683 . . . . 0.75 112.664 178.246 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.4 p -149.03 171.89 15.64 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.214 -0.594 . . . . 1.0900000000000001 112.592 -170.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.51 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 169.77 -160.31 33.32 Favored Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 115.041 -0.981 . . . . 0.16 110.744 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.36 132.01 52.9 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 117.423 0.612 . . . . 0.16 110.315 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.538 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -143.82 147.43 34.1 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.566 -0.288 . . . . 0.11 111.709 -176.445 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.793 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 64.6 mt -104.44 133.59 48.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.874 0.369 . . . . 0.33000000000000002 110.178 175.068 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -132.85 129.14 38.07 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 108.534 -0.913 . . . . 0.35999999999999999 108.534 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 56.75 34.27 24.35 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.559 0.344 . . . . 0.80000000000000004 110.977 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm 69.72 -3.98 1.54 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.27 0.841 . . . . 2.1099999999999999 113.27 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.2 p -92.2 118.03 36.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 108.664 -0.865 . . . . 0.22 108.664 170.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -75.06 145.79 42.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.02 -0.536 . . . . 1.0700000000000001 110.337 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -160.71 -160.99 11.07 Favored Glycine 0 N--CA 1.439 -1.161 0 C-N-CA 120.149 -1.024 . . . . 0.11 113.244 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -124.66 132.38 71.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 109.281 -0.637 . . . . 0.13 109.281 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.574 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.49 135.39 41.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 110.221 -0.288 . . . . 0.13 110.221 -175.327 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.6 130.42 27.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.625 -0.261 . . . . 0.10000000000000001 111.499 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.465 HD13 ' HB ' ' A' ' 103' ' ' THR . 43.3 mt -85.55 137.48 20.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.384 0.611 . . . . 0.27000000000000002 110.449 176.34 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -106.76 106.23 16.65 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.999 -1.0 . . . . 1.24 110.791 -176.014 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -118.86 169.05 10.2 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.502 -0.555 . . . . 1.2 109.502 175.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.7 t70 76.25 -0.73 3.05 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 122.381 1.086 . . . . 0.57999999999999996 109.601 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 23' ' ' SER . 33.9 m -103.55 -171.65 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 113.7 -1.591 . . . . 0.25 109.869 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.63 ' O ' HG23 ' A' ' 22' ' ' VAL . 54.9 p -71.94 168.34 23.61 Favored Pre-proline 0 C--N 1.318 -0.775 0 N-CA-C 105.259 -2.126 . . . . 1.1299999999999999 105.259 175.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -42.73 128.29 4.94 Favored 'Trans proline' 0 C--N 1.355 0.92 0 CA-C-N 121.524 1.58 . . . . 0.16 112.059 -145.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.465 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.85 142.86 18.05 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-N 114.093 -1.412 . . . . 0.10000000000000001 112.245 -162.039 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -127.47 168.48 14.84 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 114.534 -1.212 . . . . 0.32000000000000001 112.133 -168.195 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.807 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -118.16 106.77 13.18 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.649 -1.241 . . . . 0.089999999999999997 107.649 173.593 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.492 HG23 ' OG1' ' A' ' 39' ' ' THR . 6.9 m -102.96 107.2 17.92 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 120.998 0.428 . . . . 0.17000000000000001 111.23 -176.418 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -85.02 131.39 34.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.716 -0.846 . . . . 0.14000000000000001 108.716 171.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.47 ' HG2' HG23 ' A' ' 37' ' ' VAL . 60.8 mtt85 -126.43 158.83 34.98 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.918 -0.771 . . . . 1.9099999999999999 108.918 174.5 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.0 p -68.15 176.33 2.76 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.669 -0.493 . . . . 0.59999999999999998 109.669 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.5 p -58.78 -35.96 73.65 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 120.524 -0.471 . . . . 0.26000000000000001 111.538 -179.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -93.77 -28.74 15.74 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.301 -0.629 . . . . 2.1200000000000001 109.301 172.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.439 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 101.2 17.41 22.52 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.313 -0.858 . . . . 0.23000000000000001 113.198 174.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -66.12 -48.26 71.44 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.865 -0.42 . . . . 1.73 109.865 173.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.0 tttt -82.89 138.05 34.02 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.925 -0.768 . . . . 1.3 108.925 174.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.47 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.5 p -149.25 135.64 12.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.009 0.433 . . . . 0.17000000000000001 111.157 -177.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -144.58 128.92 17.86 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.881 -0.415 . . . . 0.40999999999999998 109.881 178.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.492 ' OG1' HG23 ' A' ' 28' ' ' THR . 47.0 m -117.86 137.96 52.43 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.343 0.497 . . . . 0.14999999999999999 112.343 -172.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.807 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.68 130.7 55.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 N-CA-C 108.329 -0.989 . . . . 0.12 108.329 169.242 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.41 ' O ' HG12 ' A' ' 45' ' ' ILE . 94.5 t -93.13 120.43 42.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 O-C-N 121.305 -0.872 . . . . 0.11 108.702 172.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.627 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -67.83 -18.86 64.97 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.875 0.695 . . . . 0.080000000000000002 112.875 -170.119 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.426 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 15.5 t -69.78 -13.57 62.35 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.327 -0.549 . . . . 0.87 109.84 174.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.2 p -108.99 6.81 25.5 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.934 -0.575 . . . . 0.14999999999999999 109.844 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.6 HG21 ' CD1' ' A' ' 62' ' ' LEU . 32.2 mm -109.27 138.37 36.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.671 -0.695 . . . . 0.12 109.792 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -102.58 -45.91 4.9 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.805 -0.634 . . . . 0.52000000000000002 110.631 -178.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.538 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 23.5 mtpp -133.21 173.77 11.09 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.368 0.604 . . . . 1.4099999999999999 111.861 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.823 HD11 HD12 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -153.38 142.09 20.98 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.809 -1.087 . . . . 0.72999999999999998 108.657 178.009 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.49 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 15.1 mm-40 -136.53 127.16 27.06 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 110.348 -0.241 . . . . 1.9399999999999999 110.348 -174.152 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.427 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -121.92 135.2 54.86 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 121.548 -0.72 . . . . 0.22 111.583 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.425 HG21 ' CB ' ' A' ' 57' ' ' LYS . 80.0 p -64.9 119.03 54.71 Favored Pre-proline 0 N--CA 1.467 0.403 0 CA-C-N 115.909 -0.587 . . . . 0.26000000000000001 110.949 -176.098 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.463 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 23.7 Cg_exo -55.56 159.36 11.15 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.859 2.372 . . . . 0.38 112.006 178.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.67 -14.89 63.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.91 -0.586 . . . . 0.66000000000000003 110.721 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.58 -7.68 43.38 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.474 -0.785 . . . . 1.5 110.386 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.48 ' C ' ' H ' ' A' ' 57' ' ' LYS . 42.4 m -83.88 147.35 27.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.938 -0.574 . . . . 0.84999999999999998 111.805 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -70.46 11.94 0.3 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.479 -0.782 . . . . 1.77 111.851 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.554 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 25.8 mmtp -127.03 157.96 38.21 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.58 -0.737 . . . . 1.6299999999999999 111.41 -171.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.539 ' O ' ' HG3' ' A' ' 59' ' ' MET . 70.8 mmm -130.94 96.36 4.04 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.017 -1.105 . . . . 1.1100000000000001 108.017 165.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.554 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -156.15 152.51 28.0 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.52 0.676 . . . . 0.22 111.891 -172.181 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.5 tt -131.67 119.62 21.63 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.665 -1.152 . . . . 0.10000000000000001 108.453 178.094 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.523 ' NE ' ' HG2' ' A' ' 86' ' ' ARG . 7.6 mtp180 -102.24 144.24 31.01 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 121.122 0.487 . . . . 2.9900000000000002 111.154 -178.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.937 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -122.88 111.81 17.1 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.167 -0.924 . . . . 0.13 109.228 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.669 HG13 ' CD ' ' A' ' 86' ' ' ARG . 2.8 mp -87.98 107.76 17.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 122.462 0.305 . . . . 0.28999999999999998 110.93 -171.332 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.96 143.75 35.37 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.216 -0.516 . . . . 0.54000000000000004 112.241 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.434 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.1 mttt -68.85 125.68 27.36 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.221 0.823 . . . . 0.55000000000000004 113.221 -174.335 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.679 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 2.4 t -120.75 133.42 67.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.368 -0.833 . . . . 1.73 110.182 170.16 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.607 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 24.1 m-20 -94.48 91.63 6.72 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.103 -1.073 . . . . 3.23 108.103 175.49 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.25 -3.8 1.49 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.22 0.822 . . . . 2.3900000000000001 113.22 -169.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.1 p -71.46 -12.2 61.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.134 0.492 . . . . 2.96 109.959 171.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 21.1 ptmt -76.4 42.91 0.29 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.693 0.797 . . . . 2.4900000000000002 110.772 176.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -45.33 115.67 0.97 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.689 -0.687 . . . . 3.3999999999999999 110.827 -174.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.594 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 79.6 ttt180 -94.65 163.55 13.33 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.605 -0.725 . . . . 3.7999999999999998 109.39 -172.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 93.7 mttt -130.74 146.19 52.14 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.882 -0.414 . . . . 4.29 109.882 173.48 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -88.82 -165.66 1.39 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.477 -0.783 . . . . 4.4100000000000001 110.781 -173.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -66.13 -16.56 64.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.337 0.495 . . . . 5.3399999999999999 112.337 -176.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.427 ' HB2' ' OD1' ' A' ' 78' ' ' ASN . 22.6 mt-10 -107.02 -8.0 16.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.866 0.365 . . . . 5.3799999999999999 111.088 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.72 14.32 47.2 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.529 -0.844 . . . . 4.3700000000000001 112.21 -178.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.504 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 23.3 m120 -71.28 138.9 49.74 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.899 -0.778 . . . . 4.5099999999999998 108.899 176.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -76.0 100.55 4.93 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.123 0.487 . . . . 4.2800000000000002 109.811 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.594 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 11.0 m -114.24 106.27 20.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.292 0.567 . . . . 3.1000000000000001 109.797 -177.111 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.476 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 t -80.19 128.13 74.3 Favored Pre-proline 0 C--N 1.316 -0.871 0 C-N-CA 120.307 -0.557 . . . . 2.5 110.497 -175.092 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 25.4 Cg_exo -69.39 138.45 39.04 Favored 'Trans proline' 0 CA--C 1.513 -0.563 0 C-N-CA 123.254 2.636 . . . . 1.8700000000000001 112.099 -178.378 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm -94.23 146.04 30.86 Favored Pre-proline 0 N--CA 1.427 -1.59 0 CA-C-N 115.2 -0.909 . . . . 2.7400000000000002 109.331 175.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.679 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 51.6 Cg_exo -50.46 152.24 9.02 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 122.419 2.079 . . . . 0.83999999999999997 112.13 178.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -75.18 162.75 28.21 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.091 -0.959 . . . . 1.5700000000000001 108.581 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.669 ' CD ' HG13 ' A' ' 63' ' ' ILE . 0.7 OUTLIER -154.5 116.77 4.28 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 122.025 0.917 . . . . 2.52 111.16 -176.408 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 70.2 m80 -94.69 154.52 17.28 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.695 -1.593 . . . . 0.71999999999999997 107.964 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.436 ' HG3' ' HG2' ' A' ' 61' ' ' ARG . 28.0 ttm -141.22 135.47 30.76 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 118.627 0.649 . . . . 0.27000000000000002 110.611 174.117 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.539 ' O ' ' HA ' ' A' ' 59' ' ' MET . 11.3 m-85 -126.34 134.74 51.0 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.044 -0.526 . . . . 0.27000000000000002 109.724 174.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.793 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -80.83 158.47 25.38 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.32 -0.622 . . . . 1.26 109.32 176.65 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.506 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.7 m-85 -140.16 171.25 14.43 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.896 0.379 . . . . 0.32000000000000001 110.99 -178.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -121.94 -15.04 7.93 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.12 -0.491 . . . . 2.3799999999999999 110.288 175.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.444 ' HB2' HG23 ' A' ' 96' ' ' VAL . 41.6 m-80 -135.86 122.16 20.48 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.238 0.542 . . . . 1.1000000000000001 110.68 -177.511 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.544 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.8 mmm180 -59.86 -34.8 73.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.098 -0.956 . . . . 3.0899999999999999 112.276 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.443 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 19.2 m -61.96 -32.67 73.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.854 0.359 . . . . 0.34999999999999998 110.567 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.635 ' O ' HG12 ' A' ' 100' ' ' ILE . 18.8 t -69.92 -58.8 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 CA-C-N 116.249 -0.432 . . . . 0.23000000000000001 110.363 179.047 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.575 ' HA ' HD12 ' A' ' 60' ' ' LEU . 11.6 ptp -55.84 -37.76 69.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.088 -0.505 . . . . 0.17000000000000001 111.261 -176.578 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.443 ' N ' ' HG3' ' A' ' 97' ' ' MET . 37.4 t70 -64.65 -48.23 75.57 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.628 -0.429 . . . . 0.34000000000000002 110.096 176.654 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 95' ' ' THR . 7.9 t-20 -63.42 -41.68 98.7 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.608 0.763 . . . . 1.3600000000000001 111.409 -179.274 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.656 HG22 HD11 ' A' ' 104' ' ' LEU . 30.9 mm -63.97 -58.51 7.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 109.278 -0.638 . . . . 0.12 109.278 178.082 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.851 ' HA ' HD12 ' A' ' 104' ' ' LEU . 23.5 ttpp -51.44 -47.86 62.92 Favored 'General case' 0 C--O 1.215 -0.729 0 O-C-N 123.785 0.678 . . . . 0.79000000000000004 110.02 177.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.501 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.9 ttp -48.65 -54.38 14.93 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.238 -0.892 . . . . 0.28000000000000003 111.255 176.822 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.734 ' O ' HG13 ' A' ' 107' ' ' ILE . 28.1 m -60.69 -55.2 36.11 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.835 -0.621 . . . . 0.17999999999999999 110.205 178.608 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.937 HD13 HD21 ' A' ' 62' ' ' LEU . 30.7 mt -45.8 -55.03 7.09 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.391 -0.822 . . . . 0.089999999999999997 110.613 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.761 ' HG2' HD13 ' A' ' 48' ' ' LEU . 49.8 mt-30 -53.36 -45.02 69.01 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.519 -1.219 . . . . 1.2 112.454 178.158 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.501 ' HG2' ' O ' ' A' ' 102' ' ' MET . 75.5 mm-40 -64.87 -34.96 79.63 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.674 0.75 . . . . 2.3700000000000001 109.85 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.734 HG13 ' O ' ' A' ' 103' ' ' THR . 8.9 mt -71.45 -45.49 68.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.604 -1.18 . . . . 0.14999999999999999 110.879 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.823 HD12 HD11 ' A' ' 48' ' ' LEU . 10.1 mt -63.09 -40.48 89.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.135 -0.484 . . . . 0.19 111.331 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 t -58.18 -26.5 62.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.196 -0.456 . . . . 1.1399999999999999 111.068 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -63.41 -49.11 75.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.062 0.458 . . . . 1.6399999999999999 109.883 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.426 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 34.2 m-85 -79.75 -12.16 59.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.619 -0.718 . . . . 0.65000000000000002 110.013 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -74.83 -41.17 60.42 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.102 -0.954 . . . . 0.76000000000000001 108.819 174.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -77.85 -39.67 42.73 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-N 115.465 -0.788 . . . . 2.27 110.318 175.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -95.66 42.27 1.09 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.182 -0.917 . . . . 1.2 110.981 -176.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 C--O 1.251 1.163 0 CA-C-N 115.918 -0.583 . . . . 2.7200000000000002 110.399 -177.527 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.806 0 N-CA-C 111.909 -0.477 . . . . 19.890000000000001 111.909 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 19.5 t -74.0 136.33 76.5 Favored Pre-proline 0 C--N 1.327 -0.409 0 N-CA-C 110.143 -0.317 . . . . 18.329999999999998 110.143 -179.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -77.43 56.79 5.67 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.839 2.359 . . . . 17.390000000000001 112.504 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -101.75 58.85 0.62 Allowed Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.93 -0.652 . . . . 16.359999999999999 112.09 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 30.2 p90 -97.35 118.81 64.07 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 121.053 0.454 . . . . 16.0 110.566 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -91.17 16.83 1.5 Allowed 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.921 2.414 . . . . 13.15 112.267 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -77.92 100.17 6.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.825 -0.625 . . . . 12.359999999999999 110.168 -178.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 141.73 -112.18 0.74 Allowed Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 115.702 -0.681 . . . . 9.6300000000000008 111.424 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.516 ' HG ' ' HA3' ' B' ' 530' ' ' GLY . 0.1 OUTLIER -149.17 137.52 20.87 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.601 -0.518 . . . . 8.3399999999999999 109.601 177.339 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 528' ' ' LEU . . . . . 0.406 ' H ' HD13 ' B' ' 527' ' ' LEU . 5.2 tt -111.3 108.6 18.27 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 108.878 -0.786 . . . . 10.41 108.878 172.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 7.6 t 71.46 48.26 0.34 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.991 -1.004 . . . . 7.6200000000000001 109.103 -177.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 530' ' ' GLY . . . . . 0.516 ' HA3' ' HG ' ' B' ' 527' ' ' LEU . . . -129.62 -104.6 1.11 Allowed Glycine 0 N--CA 1.436 -1.359 0 CA-C-N 114.96 -1.018 . . . . 5.1900000000000004 111.309 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -140.6 9.91 2.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.88 0.371 . . . . 5.5 110.511 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 532' ' ' GLU . . . . . 0.407 ' HB2' ' HB2' ' B' ' 527' ' ' LEU . 20.6 mt-10 -123.03 15.25 9.93 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 121.651 0.738 . . . . 5.6799999999999997 110.96 -176.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -83.65 -61.97 1.7 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.9 -1.045 . . . . 3.2200000000000002 111.935 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -92.77 -34.62 13.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.2 0.524 . . . . 4.2699999999999996 110.985 -175.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 535' ' ' SER . . . . . 0.469 ' O ' ' HB2' ' B' ' 539' ' ' ASP . 0.5 OUTLIER -75.78 -6.08 48.93 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.33 -0.85 . . . . 1.25 112.047 -173.873 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 49.6 m -88.51 -37.66 15.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.083 0.468 . . . . 2.0800000000000001 110.29 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 46.0 mm -78.49 -33.9 17.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.378 0.609 . . . . 1.29 109.359 174.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -80.84 8.5 8.08 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 121.747 0.784 . . . . 0.76000000000000001 110.262 173.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' B' ' 535' ' ' SER . 37.7 t70 -92.49 -43.32 9.24 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.082 -1.081 . . . . 1.23 108.082 170.707 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 61.3 mmm -54.49 -37.43 65.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.454 -1.248 . . . . 2.29 109.407 168.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 541' ' ' ASP . . . . . 0.443 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 36.9 t70 -53.26 -57.17 11.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 114.799 -1.091 . . . . 1.1799999999999999 110.793 174.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.519 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.3 OUTLIER -65.62 -39.35 91.4 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.037 -0.983 . . . . 0.56000000000000005 111.622 -172.412 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 33.5 t -60.24 -38.16 82.57 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.264 -0.426 . . . . 1.5800000000000001 110.788 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -72.68 -31.69 65.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.098 0.475 . . . . 0.83999999999999997 110.904 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 94.4 mt -68.95 -44.44 73.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.716 -0.675 . . . . 1.0800000000000001 111.563 -178.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 44.7 mt -70.69 -26.3 63.36 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.597 0.713 . . . . 0.96999999999999997 109.462 176.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 8.4 t -70.37 -13.91 62.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.012 -0.995 . . . . 1.4199999999999999 110.303 176.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -72.51 -20.48 61.35 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.468 0.652 . . . . 2.6699999999999999 110.107 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 67.8 mt -100.18 -49.67 11.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 115.091 -0.959 . . . . 5.2300000000000004 109.791 177.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 32.8 m -138.07 107.38 6.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.535 -0.757 . . . . 6.4000000000000004 110.234 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 44.3 m . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.403 -0.808 . . . . 7.5899999999999999 110.127 178.028 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo . . . . . 0 N--CA 1.479 0.638 0 N-CA-C 110.556 -0.594 . . . . 1.8899999999999999 110.556 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.8 p -77.84 105.02 8.75 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 121.096 0.474 . . . . 2.0499999999999998 109.933 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.491 ' HB3' ' HB ' ' A' ' 18' ' ' ILE . 75.6 m80 -83.51 6.71 19.44 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.722 -0.672 . . . . 0.75 110.448 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.8 t -152.17 155.02 36.99 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.891 -0.724 . . . . 1.0900000000000001 112.626 -168.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.565 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . -174.44 -164.31 29.15 Favored Glycine 0 N--CA 1.437 -1.245 0 CA-C-N 114.341 -1.3 . . . . 0.16 110.554 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.98 135.05 39.54 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 117.558 0.679 . . . . 0.16 110.906 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -148.76 153.26 37.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.389 -0.369 . . . . 0.11 111.647 -178.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.766 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.9 mt -112.25 128.29 68.96 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 CA-C-O 120.686 0.279 . . . . 0.33000000000000002 110.461 177.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -126.97 133.53 50.56 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 108.897 -0.779 . . . . 0.35999999999999999 108.897 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 58.85 27.77 16.58 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.758 0.423 . . . . 0.80000000000000004 110.857 -178.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt 70.5 0.06 3.1 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.218 0.607 . . . . 2.1099999999999999 112.555 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.3 p -92.7 122.46 44.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 108.545 -0.909 . . . . 0.22 108.545 167.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.9 p -81.71 145.98 30.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.224 -0.444 . . . . 1.0700000000000001 111.072 -173.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.451 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -162.68 -154.92 7.8 Favored Glycine 0 N--CA 1.439 -1.103 0 C-N-CA 120.375 -0.917 . . . . 0.11 113.461 -177.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.9 mm -126.71 130.5 71.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 109.334 -0.617 . . . . 0.13 109.334 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.575 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -100.8 137.07 29.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 110.101 -0.333 . . . . 0.13 110.101 -175.857 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.83 129.8 28.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.701 0.286 . . . . 0.10000000000000001 111.573 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.491 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 41.3 mt -85.5 139.02 18.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.237 0.542 . . . . 0.27000000000000002 109.81 174.882 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.438 ' O ' ' HA ' ' A' ' 25' ' ' ALA . 17.4 t30 -110.33 103.26 11.9 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.973 -1.012 . . . . 1.24 111.301 -174.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 31.1 mt-10 -114.61 169.76 8.82 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.863 -0.791 . . . . 1.2 108.863 174.175 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.457 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 38.0 t70 79.49 -5.59 1.91 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 122.446 1.117 . . . . 0.57999999999999996 109.776 -176.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 23' ' ' SER . 22.8 m -103.23 -172.73 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.05 0 CA-C-N 113.767 -1.561 . . . . 0.25 109.406 178.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.644 ' O ' HG23 ' A' ' 22' ' ' VAL . 59.3 p -72.41 167.92 28.31 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 105.199 -2.149 . . . . 1.1299999999999999 105.199 175.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -41.66 127.04 3.35 Favored 'Trans proline' 0 C--N 1.355 0.892 0 CA-C-N 121.317 1.506 . . . . 0.16 112.729 -143.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.438 ' HA ' ' O ' ' A' ' 19' ' ' ASN . . . -43.38 136.8 2.98 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 113.841 -1.527 . . . . 0.10000000000000001 112.895 -168.705 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.68 169.07 12.33 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 114.092 -1.413 . . . . 0.32000000000000001 111.679 -169.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.668 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -119.57 105.38 11.16 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 107.807 -1.183 . . . . 0.089999999999999997 107.807 174.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.7 m -104.58 106.89 17.56 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-O 121.155 0.502 . . . . 0.17000000000000001 111.245 -176.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.41 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 79.9 t90 -84.63 128.61 34.69 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.965 -0.754 . . . . 0.14000000000000001 108.965 172.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.474 ' HG2' HG23 ' A' ' 37' ' ' VAL . 96.1 mtt180 -120.48 158.11 27.94 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.455 -0.943 . . . . 1.9099999999999999 108.455 172.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 p -70.18 176.09 4.12 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.275 -0.639 . . . . 0.59999999999999998 109.275 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.451 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 4.2 p -57.32 -36.25 70.88 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.524 . . . . 0.26000000000000001 111.004 -179.022 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -91.82 -30.92 15.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.569 0.699 . . . . 2.1200000000000001 109.759 172.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.421 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 99.5 15.5 32.0 Favored Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.152 -0.931 . . . . 0.23000000000000001 112.769 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.92 -42.06 95.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.334 -0.617 . . . . 1.73 109.334 175.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -91.27 139.41 30.76 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.815 -0.809 . . . . 1.3 108.815 173.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.474 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.9 p -149.61 137.72 14.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 120.79 0.328 . . . . 0.17000000000000001 110.967 -179.071 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -144.51 129.04 18.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.634 -0.257 . . . . 0.40999999999999998 110.351 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 53.3 m -112.52 143.59 43.42 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.216 0.451 . . . . 0.14999999999999999 112.216 -174.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.668 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -113.6 129.89 68.62 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.722 0 N-CA-C 107.923 -1.14 . . . . 0.12 107.923 167.847 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 67.2 t -92.32 121.04 42.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 O-C-N 121.024 -1.047 . . . . 0.11 108.914 173.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.619 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -68.91 -18.38 64.1 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 113.011 0.745 . . . . 0.080000000000000002 113.011 -169.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 p -69.02 -16.76 63.79 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.574 0.702 . . . . 0.87 109.382 175.184 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.415 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 4.7 p -109.06 16.62 22.43 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.977 -1.011 . . . . 0.14999999999999999 110.088 -178.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.489 HG21 HD13 ' A' ' 62' ' ' LEU . 31.2 mm -112.25 138.38 41.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.759 -0.46 . . . . 0.12 109.759 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -102.07 -40.22 6.94 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.013 -0.54 . . . . 0.52000000000000002 110.657 -176.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.459 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 12.4 mtmm -144.96 174.46 11.0 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.872 0.367 . . . . 1.4099999999999999 111.26 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.627 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -151.34 133.63 15.32 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.632 -0.877 . . . . 0.72999999999999998 108.632 177.079 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.718 ' HG3' HD11 ' A' ' 63' ' ' ILE . 9.2 mt-30 -130.01 127.2 39.5 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 110.285 -0.265 . . . . 1.9399999999999999 110.285 -176.459 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -118.06 141.47 48.44 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 121.914 -0.492 . . . . 0.22 111.039 178.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.444 HG21 ' HB3' ' A' ' 57' ' ' LYS . 53.0 p -62.29 121.24 65.24 Favored Pre-proline 0 C--N 1.332 -0.175 0 CA-C-N 115.912 -0.585 . . . . 0.26000000000000001 110.633 -178.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 55' ' ' SER . 24.0 Cg_exo -53.96 163.58 3.04 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.66 2.24 . . . . 0.38 112.465 178.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.73 79.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.146 -0.479 . . . . 0.66000000000000003 110.598 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.0 m -76.11 -13.73 60.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.569 -0.741 . . . . 1.5 111.035 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 52' ' ' PRO . 46.1 m -75.1 135.3 41.18 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 121.697 0.761 . . . . 0.84999999999999998 111.391 179.39 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -59.46 -26.77 65.51 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.009 -1.45 . . . . 1.77 110.756 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.444 ' HB3' HG21 ' A' ' 51' ' ' THR . 37.0 mmtt -82.74 146.74 28.84 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 114.399 -1.273 . . . . 1.6299999999999999 111.493 -177.452 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.569 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.4 OUTLIER -123.07 96.63 5.09 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.032 -0.986 . . . . 1.1100000000000001 108.564 170.021 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.569 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -156.31 152.31 27.5 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 121.585 0.707 . . . . 0.22 112.069 -173.543 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -129.83 118.89 22.47 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.553 -1.203 . . . . 0.10000000000000001 108.143 177.278 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.488 ' HG3' ' CE2' ' B' ' 542' ' ' PHE . 15.0 mtm180 -101.83 133.47 46.54 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.229 0.538 . . . . 2.9900000000000002 110.886 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.944 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -111.84 107.26 16.24 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 115.099 -0.955 . . . . 0.13 109.205 176.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.718 HD11 ' HG3' ' A' ' 49' ' ' GLN . 1.4 mp -85.31 97.81 5.88 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 109.368 -0.604 . . . . 0.28999999999999998 109.368 -172.443 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.463 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -76.31 134.48 15.72 Favored Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 115.941 -0.572 . . . . 0.54000000000000004 112.46 -176.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.437 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 96.1 mttt -56.65 149.23 18.11 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 123.162 0.585 . . . . 0.55000000000000004 112.188 -176.645 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.763 HG13 ' HA ' ' A' ' 84' ' ' PRO . 1.4 m -118.45 146.25 23.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.054 -0.521 . . . . 1.73 110.176 168.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.75 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 18.7 t70 -79.04 81.76 5.28 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.02 -0.733 . . . . 3.23 109.02 176.455 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.11 -2.3 5.41 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.013 0.745 . . . . 2.3900000000000001 113.013 -169.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.16 -14.16 62.18 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.155 0.503 . . . . 2.96 110.059 170.105 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.75 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.1 ptpt -82.3 36.22 0.46 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.759 -0.655 . . . . 2.4900000000000002 110.742 175.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.508 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 31.5 mmtm -44.97 116.1 1.02 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.624 -0.51 . . . . 3.3999999999999999 109.624 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.618 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 60.4 ttt180 -96.87 164.49 12.53 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 108.755 -0.831 . . . . 3.7999999999999998 108.755 -173.065 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 57.3 mttp -127.69 141.88 51.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.987 0.422 . . . . 4.29 110.023 171.449 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -82.69 -171.07 3.3 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.466 -0.788 . . . . 4.4100000000000001 110.451 -176.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -61.27 -31.14 70.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 111.606 0.225 . . . . 5.3399999999999999 111.606 -178.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.478 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 28.1 mt-10 -85.14 -18.81 33.04 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.079 -0.248 . . . . 5.3799999999999999 111.332 -179.11 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 99.84 25.67 8.97 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.403 -0.903 . . . . 4.3700000000000001 112.952 177.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.537 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 31.1 m-80 -90.47 144.69 25.56 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.233 -0.654 . . . . 4.5099999999999998 109.233 176.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -69.86 91.45 0.65 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.883 0.373 . . . . 4.2800000000000002 110.168 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.618 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.7 m -102.68 97.38 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 CA-C-O 122.014 0.911 . . . . 3.1000000000000001 108.99 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.508 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 2.2 p -83.04 130.82 55.85 Favored Pre-proline 0 C--N 1.31 -1.15 0 CA-C-N 115.313 -0.858 . . . . 2.5 109.784 -178.221 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 47.8 Cg_exo -60.07 132.81 46.5 Favored 'Trans proline' 0 CA--C 1.512 -0.599 0 C-N-CA 122.77 2.313 . . . . 1.8700000000000001 111.993 -176.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -82.98 154.38 67.42 Favored Pre-proline 0 C--N 1.315 -0.906 0 CA-C-N 115.228 -0.897 . . . . 2.7400000000000002 109.252 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.763 ' HA ' HG13 ' A' ' 66' ' ' VAL . 21.3 Cg_exo -60.12 149.49 84.55 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.795 2.33 . . . . 0.83999999999999997 112.153 -174.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -89.63 115.63 27.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.359 0.6 . . . . 1.5700000000000001 110.256 -174.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.495 ' HG2' HG13 ' A' ' 63' ' ' ILE . 47.5 mtm180 -98.85 122.26 41.87 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 115.768 -0.651 . . . . 2.52 111.623 -170.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 59.3 m-70 -97.02 111.42 23.65 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.092 -0.958 . . . . 0.71999999999999997 109.361 -178.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.415 ' HG3' ' HG2' ' A' ' 61' ' ' ARG . 33.5 ttm -107.75 131.95 53.9 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.857 -0.737 . . . . 0.27000000000000002 111.643 -176.671 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.7 m-85 -121.19 133.06 55.17 Favored 'General case' 0 C--O 1.215 -0.714 0 CA-C-N 115.5 -0.773 . . . . 0.27000000000000002 109.869 177.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.766 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -80.05 159.23 26.24 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.231 -0.655 . . . . 1.26 109.231 176.501 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.566 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 18.7 m-85 -136.85 173.28 11.87 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.377 0.608 . . . . 0.32000000000000001 112.021 -177.392 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -118.7 -21.46 7.87 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.043 -0.98 . . . . 2.3799999999999999 110.208 178.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.482 ' HB2' HG23 ' A' ' 96' ' ' VAL . 53.4 m-80 -139.49 125.95 20.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.215 0.531 . . . . 1.1000000000000001 110.74 -177.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.588 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.7 mmm180 -57.89 -30.88 66.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.192 -0.913 . . . . 3.0899999999999999 111.997 177.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.7 m -64.27 -29.22 70.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.004 0.43 . . . . 0.34999999999999998 110.554 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.732 ' HA ' ' ND2' ' A' ' 99' ' ' ASN . 5.2 t -85.15 -46.68 17.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 116.233 -0.44 . . . . 0.23000000000000001 110.983 -177.347 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.62 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.2 ptp -61.72 -25.56 67.5 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.171 -0.612 . . . . 0.17000000000000001 109.668 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 102' ' ' MET . 20.8 t70 -77.39 -38.59 49.57 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.137 -0.483 . . . . 0.34000000000000002 110.642 172.556 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.732 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 11.2 p30 -77.12 -33.58 56.79 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.705 0.261 . . . . 1.3600000000000001 111.705 -175.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.651 HG22 HD11 ' A' ' 104' ' ' LEU . 39.2 mm -70.52 -56.02 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.529 0 N-CA-C 108.388 -0.967 . . . . 0.12 108.388 174.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.782 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.5 ttpt -48.89 -48.51 42.27 Favored 'General case' 0 C--O 1.218 -0.569 0 O-C-N 123.976 0.797 . . . . 0.79000000000000004 109.752 176.648 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.764 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 40.7 ttp -48.44 -59.62 3.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.49 -0.777 . . . . 0.28000000000000003 110.757 177.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.724 ' O ' HG13 ' A' ' 107' ' ' ILE . 60.0 m -57.77 -52.89 63.59 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.483 0.489 . . . . 0.17999999999999999 110.71 -179.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.944 HD13 HD21 ' A' ' 62' ' ' LEU . 24.7 mt -47.28 -55.42 8.74 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.486 0.66 . . . . 0.089999999999999997 110.527 175.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.547 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.3 mt-30 -51.69 -44.21 63.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.615 -1.175 . . . . 1.2 112.074 177.003 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.764 ' HG3' ' O ' ' A' ' 102' ' ' MET . 81.0 mt-30 -64.36 -35.47 80.97 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.725 0.774 . . . . 2.3700000000000001 109.367 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.724 HG13 ' O ' ' A' ' 103' ' ' THR . 7.6 mt -75.95 -43.35 39.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 114.257 -1.338 . . . . 0.14999999999999999 111.559 -176.25 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.585 HD12 HD11 ' A' ' 48' ' ' LEU . 7.2 mt -62.19 -43.15 97.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.25 0.463 . . . . 0.19 112.25 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.455 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 24.2 t -62.45 -20.17 64.26 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.69 0.281 . . . . 1.1399999999999999 111.279 -176.23 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -65.21 -44.21 89.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.518 0.675 . . . . 1.6399999999999999 109.307 173.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -87.54 -11.78 47.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.088 -0.96 . . . . 0.65000000000000002 110.303 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.455 ' CB ' ' HA ' ' A' ' 109' ' ' SER . 1.8 tpmt? -70.06 -37.91 75.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.795 -0.817 . . . . 0.76000000000000001 108.795 173.195 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -67.3 -39.16 85.92 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 115.121 -0.945 . . . . 2.27 109.951 172.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -96.82 42.0 1.1 Allowed 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 114.859 -1.064 . . . . 1.2 110.684 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.6 t70 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.583 -0.723 . . . . 2.7200000000000002 109.916 -179.119 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.774 0 N-CA-C 112.116 -0.394 . . . . 19.890000000000001 112.116 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 50.8 m -150.64 75.09 8.61 Favored Pre-proline 0 C--N 1.322 -0.587 0 N-CA-C 109.88 -0.415 . . . . 18.329999999999998 109.88 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -69.14 -21.16 36.79 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 123.278 2.652 . . . . 17.390000000000001 112.523 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 522' ' ' GLY . . . . . 0.445 ' HA2' ' HA ' ' A' ' 80' ' ' VAL . . . 81.79 -124.74 6.59 Favored Glycine 0 N--CA 1.442 -0.942 0 N-CA-C 111.154 -0.778 . . . . 16.359999999999999 111.154 -176.191 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 64.75 113.32 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.344 0 CA-C-O 121.235 0.54 . . . . 16.0 112.238 177.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -57.13 150.49 56.68 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.499 2.133 . . . . 13.15 111.253 173.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -78.05 47.14 0.63 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.99 0.367 . . . . 12.359999999999999 111.99 -174.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 63.94 -89.71 0.08 OUTLIER Glycine 0 CA--C 1.518 0.264 0 N-CA-C 114.11 0.404 . . . . 9.6300000000000008 114.11 174.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -80.12 26.45 0.35 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.446 0.535 . . . . 8.3399999999999999 112.446 -171.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 26.0 mt -66.05 -11.0 45.38 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 121.535 0.683 . . . . 10.41 110.17 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 9.3 m -113.11 -37.26 4.81 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.757 -1.111 . . . . 7.6200000000000001 108.712 174.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 108.95 -33.24 6.28 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.479 -0.782 . . . . 5.1900000000000004 113.289 174.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -100.86 -4.17 28.35 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.973 0.892 . . . . 5.5 109.124 -176.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -96.81 -0.56 47.78 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.265 -1.334 . . . . 5.6799999999999997 110.463 -178.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -73.03 -38.19 66.64 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.402 -1.272 . . . . 3.2200000000000002 110.907 -176.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -60.8 -47.62 85.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.651 -0.704 . . . . 4.2699999999999996 110.781 -177.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 11.4 p -77.41 -12.68 59.98 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.198 -0.91 . . . . 1.25 111.357 -177.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 69.2 m -80.69 -39.34 27.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.983 0.421 . . . . 2.0800000000000001 110.134 174.029 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 537' ' ' ILE . . . . . 0.438 HD13 ' HA ' ' B' ' 537' ' ' ILE . 13.3 mm -75.15 -42.82 44.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.191 -0.459 . . . . 1.29 110.511 175.328 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -75.43 4.06 8.06 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.454 0.645 . . . . 0.76000000000000001 110.923 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 539' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -80.3 -37.43 32.71 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.804 -0.813 . . . . 1.23 108.804 170.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 42.1 mtm -63.8 -32.45 73.95 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.017 -0.992 . . . . 2.29 109.349 173.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 541' ' ' ASP . . . . . 0.589 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 3.3 m-20 -65.19 -56.39 13.1 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.464 -0.789 . . . . 1.1799999999999999 110.889 173.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.488 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -65.74 -49.01 69.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.566 -0.743 . . . . 0.56000000000000005 112.454 -171.175 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 31.5 t -60.83 -37.92 83.66 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.843 0.354 . . . . 1.5800000000000001 110.546 -176.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -68.9 -23.92 64.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.083 -0.508 . . . . 0.83999999999999997 111.216 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 95.4 mt -80.01 -42.25 24.22 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.355 -0.384 . . . . 1.0800000000000001 111.461 -178.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 546' ' ' LEU . . . . . 0.444 HD11 ' HB3' ' A' ' 49' ' ' GLN . 61.0 mt -70.09 -40.77 74.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.49 0.662 . . . . 0.96999999999999997 110.214 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 39.6 m -86.21 25.61 1.15 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.141 -0.936 . . . . 1.4199999999999999 112.172 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 548' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 545' ' ' LEU . 10.2 pt20 -128.4 24.05 5.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.984 0.421 . . . . 2.6699999999999999 110.177 173.227 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 3.5 tt -69.87 111.79 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 CA-C-O 121.414 0.626 . . . . 5.2300000000000004 110.53 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 5.2 p -94.43 66.51 3.34 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.545 -0.752 . . . . 6.4000000000000004 110.03 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 21.7 t . . . . . 0 C--O 1.247 0.964 0 CA-C-N 115.272 -0.876 . . . . 7.5899999999999999 108.875 -177.846 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo . . . . . 0 N--CA 1.476 0.442 0 N-CA-C 110.778 -0.508 . . . . 1.8899999999999999 110.778 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 m -73.87 -18.4 60.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.21 -0.45 . . . . 2.0499999999999998 111.193 -178.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.445 ' HB3' ' HB ' ' A' ' 18' ' ' ILE . 75.9 m80 68.74 2.48 3.49 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.498 0.555 . . . . 0.75 112.498 175.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.2 t -153.03 157.74 40.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.779 0.8 . . . . 1.0900000000000001 112.717 -169.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.485 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -176.08 -170.04 38.33 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 114.125 -1.398 . . . . 0.16 109.83 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -93.19 135.17 34.64 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 117.71 0.755 . . . . 0.16 110.375 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.44 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -145.85 146.04 30.98 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.275 -0.42 . . . . 0.11 111.367 -177.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.455 HG12 ' HA ' ' A' ' 13' ' ' SER . 85.1 mt -107.37 120.65 59.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.304 -0.407 . . . . 0.33000000000000002 110.287 177.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -123.36 137.47 54.82 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.801 -0.814 . . . . 0.35999999999999999 108.801 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 57.27 25.66 11.39 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.659 0.384 . . . . 0.80000000000000004 110.736 -176.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt 69.14 5.63 5.2 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.774 0.657 . . . . 2.1099999999999999 112.774 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -97.48 129.9 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 108.884 -0.784 . . . . 0.22 108.884 166.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.455 ' HA ' HG12 ' A' ' 8' ' ' ILE . 15.0 m -78.53 146.07 34.52 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.02 0.438 . . . . 1.0700000000000001 110.861 -175.234 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.406 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -164.19 -160.18 11.69 Favored Glycine 0 N--CA 1.437 -1.273 0 C-N-CA 120.133 -1.032 . . . . 0.11 113.052 -178.409 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.6 mm -126.05 133.11 69.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.148 -0.686 . . . . 0.13 109.148 -178.671 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.524 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.75 134.91 42.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 109.886 -0.413 . . . . 0.13 109.886 -176.862 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.95 130.61 31.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.568 0.223 . . . . 0.10000000000000001 111.149 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.445 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 47.3 mt -86.6 139.4 17.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.311 0.577 . . . . 0.27000000000000002 110.397 175.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -110.38 105.88 15.04 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 114.933 -1.03 . . . . 1.24 111.185 -176.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -116.9 170.41 8.64 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.146 -0.687 . . . . 1.2 109.146 174.692 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t70 77.78 -1.49 2.62 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 122.505 1.145 . . . . 0.57999999999999996 109.399 -179.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' ' 23' ' ' SER . 31.6 m -103.48 -171.86 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 113.559 -1.655 . . . . 0.25 109.383 177.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.636 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.7 p -72.67 168.65 22.2 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 105.202 -2.148 . . . . 1.1299999999999999 105.202 174.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.4 ' O ' HG13 ' A' ' 41' ' ' VAL . 72.9 Cg_exo -41.53 129.0 3.59 Favored 'Trans proline' 0 C--N 1.357 0.994 0 CA-C-N 121.501 1.572 . . . . 0.16 112.368 -145.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.469 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.56 142.17 18.64 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 114.164 -1.38 . . . . 0.10000000000000001 112.381 -162.086 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.76 168.68 12.87 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.64 -1.163 . . . . 0.32000000000000001 112.019 -170.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.754 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -119.79 108.97 15.04 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.798 -1.186 . . . . 0.089999999999999997 107.798 175.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m -103.98 107.08 17.81 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 120.761 0.315 . . . . 0.17000000000000001 111.1 -176.197 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.423 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 86.9 t90 -86.85 129.04 35.04 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.122 -0.696 . . . . 0.14000000000000001 109.122 171.365 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.498 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 92.0 mtt180 -123.32 160.55 26.48 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.059 -0.719 . . . . 1.9099999999999999 109.059 172.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.4 p -70.65 175.72 4.7 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.204 -0.665 . . . . 0.59999999999999998 109.204 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.406 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.0 p -59.32 -35.88 74.62 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.221 -0.592 . . . . 0.26000000000000001 111.104 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -88.39 -32.56 18.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.579 0.704 . . . . 2.1200000000000001 109.396 171.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.498 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 98.56 14.79 36.69 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 114.957 -1.019 . . . . 0.23000000000000001 113.339 173.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -67.47 -40.96 85.31 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.186 0.517 . . . . 1.73 109.776 174.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.2 135.58 33.52 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.577 -0.897 . . . . 1.3 108.577 174.349 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 12.0 p -149.46 140.26 16.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 C-N-CA 120.846 -0.342 . . . . 0.17000000000000001 111.461 -177.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -144.32 125.4 14.51 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.832 -0.432 . . . . 0.40999999999999998 109.832 175.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 41.1 m -109.26 137.63 46.84 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.752 0.279 . . . . 0.14999999999999999 111.752 -175.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.754 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -107.98 128.84 63.02 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 108.329 -0.989 . . . . 0.12 108.329 169.583 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.409 ' O ' HG12 ' A' ' 45' ' ' ILE . 79.5 t -92.84 120.02 41.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 O-C-N 121.234 -0.916 . . . . 0.11 108.781 173.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.524 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.08 -19.59 64.07 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.077 0.769 . . . . 0.080000000000000002 113.077 -169.194 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.6 p -69.46 -14.87 63.12 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 119.821 -0.752 . . . . 0.87 109.553 175.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.6 p -109.93 11.34 24.16 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.477 -0.783 . . . . 0.14999999999999999 109.921 -179.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.597 HG21 ' CD1' ' A' ' 62' ' ' LEU . 20.5 mm -111.84 139.88 34.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.718 -0.674 . . . . 0.12 109.263 178.028 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -108.44 -40.73 5.04 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.396 -0.365 . . . . 0.52000000000000002 110.914 -176.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.535 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 34.6 mtpt -132.61 167.83 19.34 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.709 0.766 . . . . 1.4099999999999999 111.402 -178.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.594 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -150.77 132.69 15.12 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.432 -1.258 . . . . 0.72999999999999998 107.862 174.811 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.409 ' HB2' ' HE ' ' A' ' 61' ' ' ARG . 9.0 mm-40 -133.06 114.76 14.3 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.329 -0.249 . . . . 1.9399999999999999 110.329 -172.413 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.448 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -110.09 145.16 37.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.827 0.346 . . . . 0.22 110.981 -178.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 57' ' ' LYS . 76.4 p -67.54 118.42 56.91 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.765 -0.652 . . . . 0.26000000000000001 110.781 -177.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.542 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 9.6 Cg_exo -59.82 163.16 14.12 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.445 2.097 . . . . 0.38 111.737 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.96 -8.05 53.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.199 -0.455 . . . . 0.66000000000000003 111.032 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.4 t -94.22 -4.82 48.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.358 0.599 . . . . 1.5 109.676 174.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.542 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 33.9 m -87.65 143.23 27.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.601 -0.727 . . . . 0.84999999999999998 111.175 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -69.24 -12.07 61.35 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.031 -0.986 . . . . 1.77 110.615 175.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.419 ' HD3' HD11 ' B' ' 545' ' ' LEU . 1.4 mptp? -99.86 154.06 18.65 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 114.894 -1.048 . . . . 1.6299999999999999 111.391 -174.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.415 ' HE3' ' HB3' ' A' ' 58' ' ' MET . 80.5 mmm -127.67 98.25 5.13 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.109 -0.7 . . . . 1.1100000000000001 109.109 168.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.467 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.2 OUTLIER -156.36 155.59 32.45 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.869 -0.605 . . . . 0.22 111.644 -173.205 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.577 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.5 tt -130.81 119.15 21.84 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.363 -0.977 . . . . 0.10000000000000001 108.363 175.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.544 ' NH1' ' HD2' ' A' ' 86' ' ' ARG . 52.2 mtm180 -101.24 146.32 27.69 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.877 0.37 . . . . 2.9900000000000002 111.288 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.899 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -128.15 106.75 9.27 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.399 -0.819 . . . . 0.13 109.565 179.563 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.559 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.6 mp -95.71 113.97 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 122.509 0.323 . . . . 0.28999999999999998 110.478 -172.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.661 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -65.25 169.22 28.57 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 121.26 -0.495 . . . . 0.54000000000000004 113.194 178.909 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -86.31 150.9 24.02 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.871 0.367 . . . . 0.55000000000000004 110.926 177.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.695 HG22 ' HG3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -106.29 118.86 54.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 115.952 -0.567 . . . . 1.73 111.617 -174.915 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.763 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.1 t70 -92.35 77.4 5.15 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.119 -1.067 . . . . 3.23 108.119 170.323 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.433 ' HG3' ' HB ' ' A' ' 66' ' ' VAL . 43.3 mt-10 -73.16 -2.24 20.79 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.847 0.314 . . . . 2.3900000000000001 111.847 -170.037 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.8 p -71.53 -6.3 39.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.36 0.6 . . . . 2.96 110.166 171.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.763 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 17.8 ptmt -91.35 36.17 0.93 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.677 -0.692 . . . . 2.4900000000000002 110.402 175.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.578 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 13.1 mmmt -44.33 113.93 0.61 Allowed 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.132 -0.692 . . . . 3.3999999999999999 109.132 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.602 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.0 ttt180 -102.4 167.02 10.22 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.621 -0.718 . . . . 3.7999999999999998 109.303 -168.246 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.501 ' N ' ' HG2' ' A' ' 72' ' ' ARG . 56.5 mttp -132.6 128.46 37.2 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.642 -0.503 . . . . 4.29 109.642 171.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -83.3 -166.06 1.26 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.026 -0.534 . . . . 4.4100000000000001 110.021 -178.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -58.79 -26.16 63.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.913 0.387 . . . . 5.3399999999999999 111.554 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -87.27 -7.44 57.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.937 -0.574 . . . . 5.3799999999999999 111.782 -174.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.57 3.65 88.97 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.736 -0.745 . . . . 4.3700000000000001 112.347 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.425 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 93.9 m-20 -71.19 139.64 50.23 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.438 -0.579 . . . . 4.5099999999999998 109.438 175.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.504 ' CD ' ' HE3' ' A' ' 71' ' ' LYS . 34.3 tt0 -72.1 90.39 1.19 Allowed 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.529 -0.545 . . . . 4.2800000000000002 109.529 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.602 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 31.3 m -92.68 99.51 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.168 0 CA-C-O 121.785 0.803 . . . . 3.1000000000000001 109.208 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.578 ' HB ' ' HD2' ' A' ' 71' ' ' LYS . 0.8 OUTLIER -80.03 108.38 9.14 Favored Pre-proline 0 C--N 1.309 -1.165 0 N-CA-C 108.813 -0.81 . . . . 2.5 108.813 175.951 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.491 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 54.0 Cg_exo -58.23 138.8 87.83 Favored 'Trans proline' 0 CA--C 1.513 -0.527 0 C-N-CA 123.363 2.709 . . . . 1.8700000000000001 112.953 -170.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.442 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 21.9 mtpp -82.61 164.73 45.82 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 114.972 -1.013 . . . . 2.7400000000000002 109.66 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.695 ' HG3' HG22 ' A' ' 66' ' ' VAL . 17.6 Cg_exo -58.81 155.73 36.46 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.104 1.87 . . . . 0.83999999999999997 112.366 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -85.48 113.97 22.15 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 108.679 -0.86 . . . . 1.5700000000000001 108.679 174.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.544 ' HD2' ' NH1' ' A' ' 61' ' ' ARG . 29.8 ttp180 -111.5 117.24 32.47 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 114.837 -1.074 . . . . 2.52 110.553 -170.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 78.3 m-70 -95.85 148.98 22.03 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 113.749 -1.568 . . . . 0.71999999999999997 108.69 -175.088 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.426 ' HA ' ' HA ' ' A' ' 61' ' ' ARG . 32.6 ttm -141.34 129.46 22.1 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.396 -0.522 . . . . 0.27000000000000002 110.838 173.127 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.44 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.7 m-85 -118.19 127.42 53.73 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.611 -0.722 . . . . 0.27000000000000002 109.565 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -80.69 153.55 27.82 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 109.825 -0.435 . . . . 1.26 109.825 177.205 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.457 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 22.1 m-85 -133.58 170.3 15.72 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.247 0.546 . . . . 0.32000000000000001 111.543 -174.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -117.51 -13.86 10.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.245 -0.889 . . . . 2.3799999999999999 109.927 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.526 ' HB2' HG23 ' A' ' 96' ' ' VAL . 57.1 m-80 -141.31 126.17 18.13 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.038 0.447 . . . . 1.1000000000000001 110.432 -177.075 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.488 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.5 mmm180 -62.33 -34.13 76.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.413 -0.812 . . . . 3.0899999999999999 111.816 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.7 m -63.05 -32.67 74.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.404 -0.362 . . . . 0.34999999999999998 110.793 -177.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.548 ' O ' HG12 ' A' ' 100' ' ' ILE . 11.8 t -71.04 -57.45 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.23000000000000001 110.284 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.577 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.6 ptp -56.53 -39.07 72.73 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.974 -0.557 . . . . 0.17000000000000001 111.136 -176.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.433 ' N ' ' HG3' ' A' ' 97' ' ' MET . 16.0 t70 -65.13 -39.44 93.04 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.804 -0.358 . . . . 0.34000000000000002 110.36 179.042 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -75.08 -39.9 60.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.247 -0.433 . . . . 1.3600000000000001 111.763 -179.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.548 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.2 mm -63.89 -55.52 21.84 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.361 0 N-CA-C 108.656 -0.868 . . . . 0.12 108.656 176.007 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.814 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.4 ttpt -51.05 -47.51 61.75 Favored 'General case' 0 C--O 1.218 -0.565 0 O-C-N 123.827 0.704 . . . . 0.79000000000000004 109.885 176.662 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.688 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 35.2 ttp -50.33 -56.3 11.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.626 -0.715 . . . . 0.28000000000000003 110.999 177.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.708 ' O ' HG13 ' A' ' 107' ' ' ILE . 40.5 m -58.32 -53.29 59.99 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.482 0.489 . . . . 0.17999999999999999 110.557 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.899 HD13 HD21 ' A' ' 62' ' ' LEU . 25.8 mt -47.23 -54.38 10.95 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.722 -0.672 . . . . 0.089999999999999997 110.631 175.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.549 ' HG2' HD13 ' A' ' 48' ' ' LEU . 53.5 mt-30 -51.25 -46.63 62.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.698 -1.137 . . . . 1.2 112.223 177.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 102' ' ' MET . 18.9 mt-30 -60.04 -40.46 89.49 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-O 122.006 0.908 . . . . 2.3700000000000001 108.864 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.708 HG13 ' O ' ' A' ' 103' ' ' THR . 7.4 mt -69.15 -46.5 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 CA-C-N 113.878 -1.51 . . . . 0.14999999999999999 111.165 -178.721 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.576 HD12 HD11 ' A' ' 48' ' ' LEU . 6.0 mt -62.24 -42.19 94.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.223 -0.444 . . . . 0.19 111.635 -177.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.9 t -56.88 -29.69 63.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.655 0.264 . . . . 1.1399999999999999 111.022 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -61.1 -42.11 97.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.459 0.647 . . . . 1.6399999999999999 109.905 176.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -92.43 -3.93 54.49 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.217 -0.901 . . . . 0.65000000000000002 110.22 -178.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.79 -37.1 23.01 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.316 -0.856 . . . . 0.76000000000000001 108.884 176.629 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -81.28 -12.05 59.19 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.271 -0.877 . . . . 2.27 110.702 174.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -89.71 29.31 1.18 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.888 -0.596 . . . . 1.2 110.773 178.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.4 t70 . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.472 -0.775 . . . . 2.7200000000000002 110.37 -179.839 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.589 0 N-CA-C 111.877 -0.489 . . . . 19.890000000000001 111.877 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 16.4 m 60.13 85.44 0.18 Allowed Pre-proline 0 CA--C 1.533 0.317 0 C-N-CA 122.741 0.416 . . . . 18.329999999999998 110.954 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.84 113.39 1.97 Allowed 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.673 2.248 . . . . 17.390000000000001 112.604 -176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -78.37 -31.6 45.8 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.82 -0.627 . . . . 16.359999999999999 111.779 178.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 523' ' ' TYR . . . . . 0.445 ' HA ' ' HD3' ' B' ' 524' ' ' PRO . 43.8 p90 -140.3 138.65 19.36 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.64 -0.504 . . . . 16.0 109.64 177.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 524' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' B' ' 523' ' ' TYR . 33.1 Cg_exo -61.5 108.89 0.66 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.622 2.215 . . . . 13.15 111.967 178.379 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -118.72 -90.51 0.57 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.342 -0.39 . . . . 12.359999999999999 110.485 -179.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 61.56 -163.48 22.96 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 121.025 -0.607 . . . . 9.6300000000000008 112.451 -178.325 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 2.1 pp -87.67 8.4 25.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.715 0.769 . . . . 8.3399999999999999 110.58 176.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 1.2 tt -80.14 -0.26 35.2 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 106.993 -1.484 . . . . 10.41 106.993 169.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 50.7 m -138.08 173.31 11.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 113.897 -1.501 . . . . 7.6200000000000001 108.332 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 140.87 -36.4 1.76 Allowed Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.11 -1.043 . . . . 5.1900000000000004 112.071 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 531' ' ' ASP . . . . . 0.417 ' HA ' ' CE2' ' B' ' 534' ' ' PHE . 23.0 t70 -150.83 -41.22 0.12 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.535 0.684 . . . . 5.5 111.362 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -81.32 -7.55 59.59 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.268 -0.878 . . . . 5.6799999999999997 111.745 -175.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -97.13 -9.27 28.27 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.894 -1.048 . . . . 3.2200000000000002 111.515 -175.155 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 534' ' ' PHE . . . . . 0.417 ' CE2' ' HA ' ' B' ' 531' ' ' ASP . 36.9 m-85 -57.75 -48.9 78.33 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.183 0.516 . . . . 4.2699999999999996 111.482 -178.118 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 11.2 p -70.26 -27.47 64.46 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.598 -0.728 . . . . 1.25 111.094 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 11.7 m -74.72 -39.49 61.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.162 -0.472 . . . . 2.0800000000000001 110.723 178.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 537' ' ' ILE . . . . . 0.442 HD13 ' HA ' ' B' ' 537' ' ' ILE . 18.5 mm -74.8 -28.03 21.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.101 -0.5 . . . . 1.29 110.326 175.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 538' ' ' ALA . . . . . 0.475 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -71.81 -1.17 13.16 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.466 0.65 . . . . 0.76000000000000001 111.459 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 539' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -73.06 -38.52 66.44 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.746 -0.835 . . . . 1.23 108.746 170.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 85.7 mtp -65.71 -35.28 80.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.028 -0.987 . . . . 2.29 109.857 175.34 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 541' ' ' ASP . . . . . 0.542 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 0.2 OUTLIER -65.27 -49.16 70.62 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.759 -0.655 . . . . 1.1799999999999999 110.495 177.159 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.475 ' HA ' HD12 ' B' ' 545' ' ' LEU . 0.2 OUTLIER -68.32 -31.66 71.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.225 -0.898 . . . . 0.56000000000000005 111.289 -173.382 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 5.9 t -61.28 -36.79 81.0 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.034 0.445 . . . . 1.5800000000000001 109.891 179.129 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -76.0 -28.64 57.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.77 -0.65 . . . . 0.83999999999999997 110.961 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 94.6 mt -70.04 -41.42 74.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.928 -0.578 . . . . 1.0800000000000001 111.697 -177.574 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 59.1 mt -75.44 -24.93 57.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.348 0.594 . . . . 0.96999999999999997 109.791 178.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 55.7 m -93.28 27.45 2.53 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.15 -0.932 . . . . 1.4199999999999999 111.535 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -74.38 -17.2 60.84 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.476 0.655 . . . . 2.6699999999999999 109.579 172.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 24.2 mm -94.99 66.69 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 115.239 -0.892 . . . . 5.2300000000000004 109.135 176.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 20.2 t -140.6 81.72 1.82 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.509 -0.769 . . . . 6.4000000000000004 109.768 -177.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 5.6 p . . . . . 0 C--O 1.245 0.866 0 CA-C-O 118.34 -0.838 . . . . 7.5899999999999999 110.091 179.969 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo . . . . . 0 N--CA 1.478 0.578 0 N-CA-C 110.238 -0.716 . . . . 1.8899999999999999 110.238 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.405 ' HB2' ' HB3' ' A' ' 99' ' ' ASN . 30.1 m -153.57 114.67 4.12 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.932 0.396 . . . . 2.0499999999999998 110.241 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.493 ' HA ' HD12 ' A' ' 18' ' ' ILE . 25.1 m80 -92.17 8.18 39.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.96 -0.564 . . . . 0.75 110.071 175.389 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 56.9 p -157.24 168.47 27.32 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.184 -0.607 . . . . 1.0900000000000001 111.997 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.471 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 175.83 -169.11 41.72 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.108 -0.951 . . . . 0.16 110.814 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -98.07 129.07 44.92 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 117.237 0.519 . . . . 0.16 110.164 177.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.423 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -143.47 145.68 32.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.866 0.365 . . . . 0.11 111.477 -176.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.47 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 83.1 mt -102.89 129.95 53.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 116.332 -0.394 . . . . 0.33000000000000002 110.091 176.21 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.565 ' HE2' ' CD2' ' A' ' 38' ' ' HIS . 26.0 t80 -141.85 141.02 33.07 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 108.871 -0.788 . . . . 0.35999999999999999 108.871 178.015 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 62.48 24.99 14.9 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.826 -0.435 . . . . 0.80000000000000004 109.826 -176.732 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt 64.61 1.72 1.43 Allowed 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 113.54 0.941 . . . . 2.1099999999999999 113.54 -177.101 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.462 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -95.79 125.51 48.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 108.722 -0.844 . . . . 0.22 108.722 169.633 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.446 ' HA ' HG12 ' A' ' 8' ' ' ILE . 59.4 p -75.6 145.13 41.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.799 0.333 . . . . 1.0700000000000001 110.483 -176.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.462 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -160.82 -160.28 10.57 Favored Glycine 0 N--CA 1.438 -1.169 0 C-N-CA 119.742 -1.218 . . . . 0.11 113.926 -175.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.3 mm -125.71 131.76 71.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 N-CA-C 108.935 -0.765 . . . . 0.13 108.935 -179.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.56 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.33 136.98 33.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 110.272 -0.27 . . . . 0.13 110.272 -176.357 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.72 130.1 31.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.911 0.386 . . . . 0.10000000000000001 111.486 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.52 HG12 HD23 ' A' ' 27' ' ' LEU . 54.7 mt -86.43 135.25 25.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 109.918 -0.401 . . . . 0.27000000000000002 109.918 177.768 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.0 101.06 10.17 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.156 -0.475 . . . . 1.24 110.694 -176.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -114.42 169.73 8.83 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.431 -0.581 . . . . 1.2 109.431 176.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t70 76.01 -1.56 2.93 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.966 0.888 . . . . 0.57999999999999996 109.96 -177.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 23' ' ' SER . 31.6 m -102.62 -174.87 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 114.472 -1.24 . . . . 0.25 109.928 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.6 ' O ' HG23 ' A' ' 22' ' ' VAL . 58.3 m -73.84 164.03 64.08 Favored Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 105.045 -2.206 . . . . 1.1299999999999999 105.045 174.05 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -41.18 127.73 2.94 Favored 'Trans proline' 0 C--N 1.352 0.73 0 CA-C-N 121.15 1.446 . . . . 0.16 112.629 -137.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.458 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -51.49 141.27 16.16 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 113.713 -1.585 . . . . 0.10000000000000001 112.164 -165.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -125.43 166.76 16.01 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 114.37 -1.286 . . . . 0.32000000000000001 111.844 -170.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -115.53 105.03 12.33 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 107.422 -1.325 . . . . 0.089999999999999997 107.422 173.538 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.8 m -99.03 106.9 19.2 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 120.933 0.397 . . . . 0.17000000000000001 111.056 -176.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -84.48 132.56 34.53 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.907 -0.775 . . . . 0.14000000000000001 108.907 171.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.495 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 66.6 mtt180 -124.6 159.09 31.51 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 108.463 -0.94 . . . . 1.9099999999999999 108.463 174.733 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.0 p -71.96 177.57 4.23 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.987 -0.746 . . . . 0.59999999999999998 108.987 177.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.462 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.2 p -60.19 -33.84 72.79 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.969 -0.692 . . . . 0.26000000000000001 110.898 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -87.73 -31.63 19.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.76 0.79 . . . . 2.1200000000000001 109.394 171.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.495 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 93.02 11.02 59.22 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 114.51 -1.223 . . . . 0.23000000000000001 112.29 177.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -60.58 -45.23 94.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.343 -0.614 . . . . 1.73 109.343 173.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.5 tttm -83.52 138.68 33.31 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.652 -0.87 . . . . 1.3 108.652 172.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.454 HG23 ' HG2' ' A' ' 30' ' ' ARG . 9.8 p -143.81 139.88 25.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 120.849 0.356 . . . . 0.17000000000000001 110.552 -178.456 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.565 ' CD2' ' HE2' ' A' ' 9' ' ' PHE . 43.6 t-80 -145.09 115.19 7.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.578 -0.283 . . . . 0.40999999999999998 110.321 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.436 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 50.8 m -108.19 133.74 52.03 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.607 0.595 . . . . 0.14999999999999999 112.607 -174.609 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.35 130.17 52.66 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.587 0 N-CA-C 108.082 -1.081 . . . . 0.12 108.082 168.989 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 45' ' ' ILE . 74.5 t -93.01 120.68 42.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 O-C-N 121.193 -0.942 . . . . 0.11 109.199 173.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.596 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -68.73 -20.5 64.39 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.916 0.71 . . . . 0.080000000000000002 112.916 -170.043 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.5 p -67.49 -18.1 64.93 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.948 -0.76 . . . . 0.87 108.948 176.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.414 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 5.3 p -109.03 14.1 24.22 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.142 -0.936 . . . . 0.14999999999999999 110.07 -177.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.487 HG21 ' CD1' ' A' ' 62' ' ' LEU . 24.7 mm -110.06 138.76 36.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.168 -0.679 . . . . 0.12 109.168 177.279 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.476 ' HB2' ' HG2' ' A' ' 65' ' ' LYS . 37.2 t70 -101.84 -41.58 6.46 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.278 -0.419 . . . . 0.52000000000000002 110.487 -176.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.431 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 13.1 mtmt -144.51 175.75 9.9 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.983 0.42 . . . . 1.4099999999999999 111.255 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.778 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -151.81 140.35 20.65 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.704 -0.85 . . . . 0.72999999999999998 108.704 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.413 ' HB3' HD11 ' B' ' 546' ' ' LEU . 19.7 mm-40 -139.72 115.89 10.44 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.047 0.385 . . . . 1.9399999999999999 111.734 -173.744 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.496 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -111.26 144.84 39.78 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.73 0.3 . . . . 0.22 111.661 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.467 ' N ' ' HZ ' ' B' ' 542' ' ' PHE . 61.2 p -64.76 123.71 84.22 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-N 115.827 -0.624 . . . . 0.26000000000000001 110.898 -177.557 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.439 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 35.1 Cg_exo -54.97 157.16 13.76 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.658 2.239 . . . . 0.38 111.417 175.661 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.59 -19.78 65.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.224 -0.444 . . . . 0.66000000000000003 111.814 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 t -93.29 -14.45 26.96 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.166 0.508 . . . . 1.5 110.443 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.439 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 17.6 m -65.95 137.39 57.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.672 -0.695 . . . . 0.84999999999999998 111.299 177.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -50.55 -34.86 27.15 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-N 114.748 -1.115 . . . . 1.77 110.419 172.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.494 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 34.4 mmtt -86.3 149.99 24.66 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 113.449 -1.705 . . . . 1.6299999999999999 112.123 -171.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.403 ' O ' ' HG3' ' A' ' 59' ' ' MET . 4.3 mtp -128.82 98.53 5.0 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.831 -1.077 . . . . 1.1100000000000001 109.238 171.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.51 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.4 OUTLIER -156.49 156.33 33.54 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.651 -0.704 . . . . 0.22 111.045 -171.888 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -129.87 119.07 22.71 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.049 -1.093 . . . . 0.10000000000000001 108.049 175.787 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.519 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 47.9 mtm180 -99.97 141.98 32.06 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.208 0.528 . . . . 2.9900000000000002 110.788 -178.6 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.956 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -120.36 104.62 10.18 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 114.97 -1.014 . . . . 0.13 108.814 177.162 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.521 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.9 mp -84.37 97.21 4.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.285 -0.635 . . . . 0.28999999999999998 109.285 -174.383 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.487 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -72.59 148.68 42.32 Favored Glycine 0 N--CA 1.442 -0.942 0 CA-C-N 115.461 -0.791 . . . . 0.54000000000000004 111.904 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.476 ' HG2' ' HB2' ' A' ' 46' ' ' ASP . 91.9 mttt -68.57 154.12 42.48 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.027 0.441 . . . . 0.55000000000000004 111.793 -176.563 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.65 HG13 ' HA ' ' A' ' 84' ' ' PRO . 0.7 OUTLIER -119.42 156.32 21.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.578 -0.737 . . . . 1.73 109.579 168.115 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.67 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 12.7 m-20 -84.42 79.7 9.47 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.384 -0.969 . . . . 3.23 108.384 174.101 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.47 -2.88 3.65 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.187 -0.46 . . . . 2.3900000000000001 112.039 -171.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.7 p -67.9 -16.1 63.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.376 0.608 . . . . 2.96 110.336 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.5 ptpt -79.55 42.88 0.53 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.584 -0.735 . . . . 2.4900000000000002 111.188 177.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -44.24 116.68 1.06 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.328 0.585 . . . . 3.3999999999999999 109.921 -176.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.407 ' HG2' ' N ' ' A' ' 73' ' ' LYS . 77.0 ttt180 -105.89 165.83 10.92 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.072 -0.967 . . . . 3.7999999999999998 109.853 -166.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.596 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 61.7 mttp -130.63 139.35 50.38 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.925 -0.398 . . . . 4.29 109.925 170.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.48 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 2.9 p-10 -86.62 -168.6 2.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.017 -0.538 . . . . 4.4100000000000001 110.377 -177.222 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -58.9 -31.2 68.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.705 0.288 . . . . 5.3399999999999999 111.618 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.48 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 16.5 mt-10 -80.18 -14.9 58.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 5.3799999999999999 110.898 -179.013 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.94 16.54 59.43 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.738 -0.744 . . . . 4.3700000000000001 111.695 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.596 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 53.4 m-20 -77.11 138.98 39.84 Favored 'General case' 0 CA--C 1.512 -0.519 0 N-CA-C 109.043 -0.725 . . . . 4.5099999999999998 109.043 178.383 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -69.79 90.08 0.59 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.49 -0.559 . . . . 4.2800000000000002 109.49 176.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 27.9 m -96.32 123.87 48.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.565 0.698 . . . . 3.1000000000000001 110.044 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.468 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 t -90.59 122.47 67.07 Favored Pre-proline 0 C--N 1.313 -1.002 0 N-CA-C 108.452 -0.944 . . . . 2.5 108.452 177.319 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 33.4 Cg_exo -62.57 136.82 60.73 Favored 'Trans proline' 0 CA--C 1.513 -0.574 0 C-N-CA 123.009 2.473 . . . . 1.8700000000000001 111.642 -176.174 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -80.86 149.23 66.78 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.203 -0.908 . . . . 2.7400000000000002 109.607 -177.289 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.65 ' HA ' HG13 ' A' ' 66' ' ' VAL . 23.0 Cg_exo -61.62 154.3 60.98 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.771 2.314 . . . . 0.83999999999999997 111.99 -177.159 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 64' ' ' GLY . 40.9 mt-30 -68.65 153.05 44.49 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.659 -0.867 . . . . 1.5700000000000001 108.659 178.677 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.442 ' HG2' HG13 ' A' ' 63' ' ' ILE . 92.5 mtm-85 -141.58 120.62 12.87 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.779 0.8 . . . . 2.52 111.503 -177.113 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.519 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 52.3 m80 -95.73 146.83 24.21 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.266 -1.334 . . . . 0.71999999999999997 107.785 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.51 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 27.6 ttm -140.29 125.91 19.17 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 118.891 0.769 . . . . 0.27000000000000002 111.775 175.364 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.438 ' O ' ' HA ' ' A' ' 59' ' ' MET . 10.1 m-85 -112.82 127.26 56.12 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.39 -0.823 . . . . 0.27000000000000002 109.842 178.553 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.12 149.51 29.13 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.924 0.392 . . . . 1.26 110.284 177.388 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.455 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 25.0 m-85 -131.71 174.16 10.41 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.297 0.57 . . . . 0.32000000000000001 111.533 -174.536 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -119.51 -21.18 7.5 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.017 -0.992 . . . . 2.3799999999999999 109.572 175.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.593 ' HB2' HG23 ' A' ' 96' ' ' VAL . 61.2 m-20 -130.55 126.89 37.9 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.046 -0.525 . . . . 1.1000000000000001 110.525 -173.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.567 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 10.6 mmm180 -64.4 -32.86 74.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.627 -0.715 . . . . 3.0899999999999999 111.874 178.083 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.2 m -62.34 -39.0 91.65 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.89 0.376 . . . . 0.34999999999999998 110.937 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.593 HG23 ' HB2' ' A' ' 93' ' ' ASN . 13.0 t -67.84 -55.21 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-N 116.025 -0.534 . . . . 0.23000000000000001 110.384 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.617 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.2 ptp -59.05 -36.15 74.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.268 -0.424 . . . . 0.17000000000000001 111.05 -176.253 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -64.35 -45.53 87.37 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.55 -0.296 . . . . 0.34000000000000002 110.274 176.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.405 ' HB3' ' HB2' ' A' ' 2' ' ' SER . 31.1 m-20 -70.2 -42.91 71.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.999 -0.546 . . . . 1.3600000000000001 111.868 -177.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.599 HG22 HD11 ' A' ' 104' ' ' LEU . 38.8 mm -61.41 -55.93 21.2 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 109.024 -0.732 . . . . 0.12 109.024 178.357 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.813 ' HA ' HD12 ' A' ' 104' ' ' LEU . 21.2 ttpp -51.36 -51.23 56.37 Favored 'General case' 0 C--O 1.218 -0.584 0 O-C-N 123.742 0.652 . . . . 0.79000000000000004 110.05 177.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.596 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 45.8 ttp -46.82 -53.45 11.98 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.061 -0.972 . . . . 0.28000000000000003 111.365 177.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.72 ' O ' HG13 ' A' ' 107' ' ' ILE . 20.0 m -62.56 -52.23 64.23 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.201 -0.454 . . . . 0.17999999999999999 110.751 179.381 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.956 HD13 HD21 ' A' ' 62' ' ' LEU . 33.0 mt -47.22 -53.36 13.45 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.646 0.736 . . . . 0.089999999999999997 110.62 175.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.768 ' HG2' HD13 ' A' ' 48' ' ' LEU . 57.4 mt-30 -55.29 -39.8 70.32 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.258 -1.337 . . . . 1.2 112.125 177.43 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.596 ' HG2' ' O ' ' A' ' 102' ' ' MET . 25.9 mm-40 -69.25 -25.67 64.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.556 0.693 . . . . 2.3700000000000001 110.218 178.586 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.72 HG13 ' O ' ' A' ' 103' ' ' THR . 18.4 mt -82.18 -46.15 19.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 114.952 -1.022 . . . . 0.14999999999999999 111.08 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.778 HD12 HD11 ' A' ' 48' ' ' LEU . 11.0 mt -62.68 -40.4 88.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.039 -0.528 . . . . 0.19 111.541 -176.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.5 p -61.44 -20.63 63.32 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.373 -0.376 . . . . 1.1399999999999999 111.802 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -66.28 -51.99 51.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.587 0.708 . . . . 1.6399999999999999 109.309 173.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -78.18 -16.58 57.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.081 -0.963 . . . . 0.65000000000000002 110.374 -178.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -65.93 -36.16 82.6 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.392 -0.822 . . . . 0.76000000000000001 109.329 174.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -79.34 -39.35 32.93 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-N 115.538 -0.756 . . . . 2.27 109.821 175.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -90.59 41.55 1.06 Allowed 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.268 -0.878 . . . . 1.2 110.808 -177.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.2 t70 . . . . . 0 C--O 1.247 0.962 0 CA-C-N 115.597 -0.729 . . . . 2.7200000000000002 110.59 -176.709 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.672 0 N-CA-C 112.126 -0.39 . . . . 19.890000000000001 112.126 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 10.7 p -87.3 135.3 34.81 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.204 -0.295 . . . . 18.329999999999998 110.204 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.63 95.43 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.908 2.406 . . . . 17.390000000000001 112.022 177.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -84.94 -172.67 49.37 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.851 -0.69 . . . . 16.359999999999999 111.913 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -93.39 123.18 61.2 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-O 120.654 0.264 . . . . 16.0 110.343 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.69 65.89 3.87 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 123.241 2.627 . . . . 13.15 112.999 -178.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -125.61 17.68 8.12 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.147 -0.479 . . . . 12.359999999999999 110.141 178.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -84.15 -53.02 3.41 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.775 -0.726 . . . . 9.6300000000000008 111.851 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.46 ' N ' HD13 ' B' ' 527' ' ' LEU . 0.0 OUTLIER -132.34 -168.11 2.0 Allowed 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 120.345 0.117 . . . . 8.3399999999999999 110.982 179.01 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 4.4 tt 53.22 47.16 25.0 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 107.944 -1.132 . . . . 10.41 107.944 -173.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 40.0 t 69.44 -60.05 0.47 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 114.27 -1.332 . . . . 7.6200000000000001 110.157 -171.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 82.88 -59.1 5.01 Favored Glycine 0 N--CA 1.44 -1.049 0 N-CA-C 110.611 -0.995 . . . . 5.1900000000000004 110.611 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 10.2 t70 169.44 -41.2 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 113.644 -1.278 . . . . 5.5 108.526 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 532' ' ' GLU . . . . . 0.447 ' HA ' ' OG ' ' B' ' 535' ' ' SER . 29.4 mt-10 -80.93 13.09 2.85 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.347 -1.751 . . . . 5.6799999999999997 111.775 -167.236 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -95.67 -30.95 13.48 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.501 -1.227 . . . . 3.2200000000000002 110.074 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -109.92 -33.36 6.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.976 -0.556 . . . . 4.2699999999999996 110.511 178.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 535' ' ' SER . . . . . 0.497 ' O ' ' HB2' ' B' ' 539' ' ' ASP . 78.9 p -70.41 -19.88 62.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.632 -0.713 . . . . 1.25 110.373 -178.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 536' ' ' SER . . . . . 0.422 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 15.5 p -65.03 -41.08 95.57 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.215 0.531 . . . . 2.0800000000000001 110.775 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 34.8 mm -79.27 -37.91 19.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.762 -0.654 . . . . 1.29 110.563 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -76.31 -1.53 27.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.848 0.833 . . . . 0.76000000000000001 110.339 177.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.497 ' HB2' ' O ' ' B' ' 535' ' ' SER . 19.2 t70 -85.61 -47.83 9.47 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.418 -1.264 . . . . 1.23 109.588 175.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 49.4 ttm -57.83 -34.63 69.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.846 -1.07 . . . . 2.29 109.478 174.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -57.26 -42.54 81.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.254 -1.339 . . . . 1.1799999999999999 111.233 176.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.467 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -67.64 -39.61 84.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.935 -0.575 . . . . 0.56000000000000005 112.011 -170.989 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 34.0 m -61.4 -23.34 65.74 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 116.295 -0.411 . . . . 1.5800000000000001 111.26 -178.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -83.47 -36.75 23.91 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.263 -0.426 . . . . 0.83999999999999997 110.319 175.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.23 -40.58 97.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.935 -0.575 . . . . 1.0800000000000001 112.439 -176.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 546' ' ' LEU . . . . . 0.413 HD11 ' HB3' ' A' ' 49' ' ' GLN . 17.3 mt -77.46 -11.24 59.83 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.478 0.656 . . . . 0.96999999999999997 110.256 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 52.2 m -112.5 42.02 1.91 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.143 -0.935 . . . . 1.4199999999999999 110.697 176.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -104.5 4.27 32.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.491 . . . . 2.6699999999999999 110.773 177.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 23.6 mm 58.86 55.78 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 115.263 -0.88 . . . . 5.2300000000000004 110.321 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 17.9 m -95.63 -26.73 15.63 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.903 -0.589 . . . . 6.4000000000000004 110.929 -178.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 C--O 1.251 1.159 0 CA-C-O 118.401 -0.809 . . . . 7.5899999999999999 111.291 -179.895 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo . . . . . 0 N--CA 1.482 0.796 0 N-CA-C 111.377 -0.278 . . . . 1.8899999999999999 111.377 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 3' ' ' HIS . 32.8 p -170.01 -39.59 0.02 OUTLIER 'General case' 0 C--O 1.234 0.248 0 C-N-CA 120.979 -0.288 . . . . 2.0499999999999998 111.697 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.425 ' HB2' ' O ' ' A' ' 2' ' ' SER . 70.7 m80 70.3 -5.43 1.35 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.302 0.641 . . . . 0.75 112.235 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.0 p -150.63 165.31 33.76 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.089 0.774 . . . . 1.0900000000000001 113.089 -170.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.487 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . -179.76 -161.8 27.65 Favored Glycine 0 N--CA 1.443 -0.862 0 CA-C-N 114.472 -1.24 . . . . 0.16 110.434 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.92 133.53 47.88 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.438 0.619 . . . . 0.16 110.407 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.611 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -147.47 148.1 30.89 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.17 0.433 . . . . 0.11 112.17 -176.333 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.816 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.7 mt -107.66 124.19 63.54 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-O 120.818 0.342 . . . . 0.33000000000000002 110.915 177.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -123.78 133.81 53.76 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.739 -0.837 . . . . 0.35999999999999999 108.739 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 53.95 32.06 14.62 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 122.804 0.441 . . . . 0.80000000000000004 110.947 -177.097 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.4 mtpt 70.98 -1.82 2.55 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.435 0.902 . . . . 2.1099999999999999 113.435 178.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.4 p -92.56 118.78 38.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.792 -0.818 . . . . 0.22 108.792 169.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.412 ' HA ' HG12 ' A' ' 8' ' ' ILE . 79.3 p -72.93 145.93 46.45 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.161 -0.472 . . . . 1.0700000000000001 110.656 -176.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . 0.435 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -163.82 -157.44 9.35 Favored Glycine 0 N--CA 1.439 -1.164 0 C-N-CA 120.106 -1.045 . . . . 0.11 113.214 -177.652 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.1 mm -126.17 132.12 70.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 109.404 -0.591 . . . . 0.13 109.404 -178.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.548 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -100.74 134.89 39.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.859 -0.423 . . . . 0.13 109.859 -177.453 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.4 128.78 28.12 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.502 -0.317 . . . . 0.10000000000000001 111.443 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.426 HD13 ' HB ' ' A' ' 103' ' ' THR . 46.9 mt -85.46 138.67 18.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 121.267 0.556 . . . . 0.27000000000000002 109.973 175.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.403 HD22 ' HA ' ' A' ' 19' ' ' ASN . 0.9 OUTLIER -110.42 103.28 11.9 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 114.917 -1.038 . . . . 1.24 110.947 -175.24 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -116.58 169.05 9.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.319 -0.623 . . . . 1.2 109.319 175.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.7 t70 78.35 -3.31 2.31 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 122.251 1.025 . . . . 0.57999999999999996 109.664 -176.593 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 23' ' ' SER . 27.1 m -102.82 -174.55 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 113.918 -1.492 . . . . 0.25 109.331 178.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.638 ' O ' HG23 ' A' ' 22' ' ' VAL . 64.6 m -72.94 167.92 29.46 Favored Pre-proline 0 C--N 1.314 -0.964 0 N-CA-C 105.404 -2.073 . . . . 1.1299999999999999 105.404 175.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.417 ' O ' HG13 ' A' ' 41' ' ' VAL . 93.7 Cg_exo -41.15 129.34 3.11 Favored 'Trans proline' 0 C--N 1.354 0.82 0 CA-C-N 121.166 1.452 . . . . 0.16 112.531 -141.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -52.83 138.75 28.76 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 114.182 -1.372 . . . . 0.10000000000000001 112.2 -162.493 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -118.89 167.44 11.72 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.094 -0.957 . . . . 0.32000000000000001 111.797 -171.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.796 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -116.75 105.59 12.56 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 106.988 -1.486 . . . . 0.089999999999999997 106.988 170.397 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.411 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.0 m -102.43 106.28 16.99 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 120.885 0.374 . . . . 0.17000000000000001 110.801 -174.677 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -86.29 129.42 34.86 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 109.009 -0.737 . . . . 0.14000000000000001 109.009 173.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.469 ' HG2' HG23 ' A' ' 37' ' ' VAL . 73.4 mtt180 -124.15 157.48 34.57 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.365 -0.976 . . . . 1.9099999999999999 108.365 173.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 p -68.08 175.45 3.16 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.076 -0.712 . . . . 0.59999999999999998 109.076 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.435 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 7.0 p -57.27 -44.27 83.8 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 118.362 0.528 . . . . 0.26000000000000001 110.678 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -82.73 -26.38 32.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.753 -0.658 . . . . 2.1200000000000001 109.719 172.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.13 16.49 47.17 Favored Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.184 -0.916 . . . . 0.23000000000000001 112.885 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -62.16 -54.03 46.85 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.478 -0.564 . . . . 1.73 109.478 174.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt -80.93 140.3 35.37 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.517 -0.765 . . . . 1.3 109.186 176.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.469 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.9 p -149.32 134.81 11.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.022 0.439 . . . . 0.17000000000000001 111.078 -178.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -139.83 129.16 24.01 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.484 -0.561 . . . . 0.40999999999999998 109.484 178.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.411 ' OG1' HG23 ' A' ' 28' ' ' THR . 25.1 m -117.56 129.26 55.67 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.262 0.468 . . . . 0.14999999999999999 112.262 -172.259 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.796 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -97.3 128.99 48.02 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.629 0 N-CA-C 107.797 -1.186 . . . . 0.12 107.797 168.775 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.417 HG13 ' O ' ' A' ' 24' ' ' PRO . 68.0 t -92.72 120.8 42.68 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 N-CA-C 108.208 -1.034 . . . . 0.11 108.208 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -67.04 -20.7 65.89 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.19 0.811 . . . . 0.080000000000000002 113.19 -169.036 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.7 p -68.41 -15.53 63.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.225 0.536 . . . . 0.87 109.906 175.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.2 p -106.26 9.93 31.91 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.531 -0.758 . . . . 0.14999999999999999 109.874 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.528 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.7 mm -111.9 143.33 21.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.876 -0.602 . . . . 0.12 109.515 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -107.03 -44.69 4.33 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.392 -0.367 . . . . 0.52000000000000002 110.72 -178.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.49 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 9.6 mtmm -138.92 171.53 14.19 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.452 -0.34 . . . . 1.4099999999999999 111.212 -176.172 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.606 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -150.64 135.4 17.4 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.21 -0.663 . . . . 0.72999999999999998 109.21 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.537 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 79.7 mm-40 -131.57 120.11 22.43 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 111.934 0.346 . . . . 1.9399999999999999 111.934 -170.196 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.18 141.93 47.49 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 121.974 -0.454 . . . . 0.22 111.937 -177.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.6 p -68.58 121.96 82.88 Favored Pre-proline 0 N--CA 1.464 0.261 0 CA-C-N 115.848 -0.615 . . . . 0.26000000000000001 110.712 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.465 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 11.1 Cg_exo -59.57 161.08 18.5 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.395 2.063 . . . . 0.38 111.433 175.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.84 -23.51 66.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.003 0.43 . . . . 0.66000000000000003 110.748 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 42.5 m -76.41 -19.26 58.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.641 . . . . 1.5 110.648 176.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.465 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 73.2 m -78.15 134.47 37.65 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.373 -0.831 . . . . 0.84999999999999998 110.316 177.294 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -57.96 -26.49 62.36 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 121.708 0.765 . . . . 1.77 110.673 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.588 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 42.4 mmtm -77.81 151.74 33.81 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 114.56 -1.2 . . . . 1.6299999999999999 111.435 -176.488 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.534 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -127.31 95.57 4.31 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 107.927 -1.138 . . . . 1.1100000000000001 107.927 168.628 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.588 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.13 151.66 28.54 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 121.62 0.724 . . . . 0.22 112.084 -173.537 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.9 tt -127.76 119.32 25.5 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.408 -1.269 . . . . 0.10000000000000001 107.936 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.567 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 30.3 mtm180 -101.01 144.98 29.29 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.111 0.481 . . . . 2.9900000000000002 111.119 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.915 HD21 HD13 ' A' ' 104' ' ' LEU . 1.1 mm? -122.64 106.18 10.74 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.208 -0.905 . . . . 0.13 109.097 178.323 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.527 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -85.34 98.77 6.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.742 -0.466 . . . . 0.28999999999999998 109.742 -173.679 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.508 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -74.03 136.73 22.03 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.752 -0.658 . . . . 0.54000000000000004 112.443 -178.189 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.476 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 82.0 mttt -53.63 132.82 41.31 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 112.831 0.678 . . . . 0.55000000000000004 112.831 -176.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.686 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 0.9 OUTLIER -121.34 140.92 43.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.09 -0.959 . . . . 1.73 110.611 174.038 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.696 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 15.3 t70 -80.75 78.7 7.5 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.946 -1.024 . . . . 3.23 109.222 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -65.65 -3.49 4.78 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.676 0.621 . . . . 2.3900000000000001 112.676 -169.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.0 p -75.89 -7.93 55.7 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.26 0.552 . . . . 2.96 110.239 170.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.696 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.9 ptmt -80.17 37.45 0.38 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.44 -0.8 . . . . 2.4900000000000002 110.719 176.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.532 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 29.8 mmtm -45.23 114.54 0.75 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.945 -0.571 . . . . 3.3999999999999999 110.354 -175.231 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.0 ttt180 -91.26 158.88 16.33 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 107.909 -1.145 . . . . 3.7999999999999998 107.909 -176.415 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 97.3 mttt -134.4 140.56 46.38 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 109.535 -0.543 . . . . 4.29 109.535 174.737 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.46 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 1.6 p-10 -80.14 -169.46 2.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.126 -0.488 . . . . 4.4100000000000001 110.527 -177.098 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -58.53 -31.75 68.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.727 0.298 . . . . 5.3399999999999999 111.662 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.519 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 16.5 mt-10 -83.7 -32.42 25.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.744 0.307 . . . . 5.3799999999999999 110.921 -178.009 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 113.78 18.24 7.04 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.594 -0.813 . . . . 4.3700000000000001 112.32 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.519 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 32.2 m-80 -76.11 131.81 39.65 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.172 -0.677 . . . . 4.5099999999999998 109.172 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.08 96.38 0.62 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.098 0.475 . . . . 4.2800000000000002 109.932 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.7 m -105.45 99.32 8.24 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-O 121.605 0.716 . . . . 3.1000000000000001 109.077 177.441 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.532 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -87.53 121.31 71.16 Favored Pre-proline 0 C--N 1.312 -1.033 0 CA-C-N 116.078 -0.51 . . . . 2.5 110.2 -177.723 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.447 ' HG2' ' HE2' ' A' ' 70' ' ' LYS . 52.1 Cg_exo -56.7 144.47 86.3 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.975 2.45 . . . . 1.8700000000000001 112.135 -178.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.593 ' HD3' ' H ' ' A' ' 83' ' ' LYS . 0.9 OUTLIER -91.81 147.24 34.6 Favored Pre-proline 0 C--N 1.312 -1.03 0 N-CA-C 108.254 -1.017 . . . . 2.7400000000000002 108.254 178.702 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.686 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 40.1 Cg_exo -52.64 147.08 32.07 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.566 2.177 . . . . 0.83999999999999997 111.841 179.016 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -76.09 112.55 12.65 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-N 115.615 -0.721 . . . . 1.5700000000000001 109.204 -172.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 84' ' ' PRO . 76.1 mtt180 -103.28 119.29 38.59 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.458 -0.792 . . . . 2.52 110.468 -170.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.567 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 70.0 m80 -93.18 148.16 22.26 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 107.497 -1.297 . . . . 0.71999999999999997 107.497 -177.525 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 35.2 ttm -140.4 127.11 20.4 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 119.687 -0.805 . . . . 0.27000000000000002 111.666 179.063 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.596 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.0 m-85 -118.11 130.04 55.9 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.418 -0.81 . . . . 0.27000000000000002 109.536 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.816 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -79.71 159.33 26.68 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.718 -0.475 . . . . 1.26 109.718 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.475 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 28.8 m-85 -138.73 175.33 9.65 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 120.752 0.311 . . . . 0.32000000000000001 110.765 -178.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -124.02 -12.3 7.49 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.851 -0.613 . . . . 2.3799999999999999 109.823 173.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.536 ' HB2' HG23 ' A' ' 96' ' ' VAL . 46.6 m-80 -138.06 128.3 26.03 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.067 -0.515 . . . . 1.1000000000000001 110.252 -177.595 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.55 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 13.9 mmm180 -67.24 -30.23 70.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.528 -0.76 . . . . 3.0899999999999999 111.85 -179.604 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.9 m -61.88 -39.8 93.18 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.979 0.418 . . . . 0.34999999999999998 110.549 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.578 ' O ' HG12 ' A' ' 100' ' ' ILE . 8.1 t -65.92 -56.03 16.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.899 -0.591 . . . . 0.23000000000000001 110.4 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.583 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.8 ptp -57.44 -38.03 73.78 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 116.235 -0.439 . . . . 0.17000000000000001 111.067 -176.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.53 -43.58 93.54 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.449 -0.5 . . . . 0.34000000000000002 110.466 177.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -70.65 -39.28 73.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.141 -0.482 . . . . 1.3600000000000001 111.585 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.606 HG22 HD11 ' A' ' 104' ' ' LEU . 34.0 mm -63.89 -56.99 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 108.895 -0.779 . . . . 0.12 108.895 175.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.797 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.1 ttpt -49.99 -48.75 52.2 Favored 'General case' 0 C--O 1.22 -0.47 0 O-C-N 123.926 0.766 . . . . 0.79000000000000004 109.793 176.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.684 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 41.9 ttp -49.09 -56.36 9.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.54 -0.755 . . . . 0.28000000000000003 111.201 177.553 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.728 ' O ' HG13 ' A' ' 107' ' ' ILE . 32.3 m -58.5 -53.49 57.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.15 -0.477 . . . . 0.17999999999999999 110.596 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.915 HD13 HD21 ' A' ' 62' ' ' LEU . 26.1 mt -47.5 -53.61 13.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.705 -0.68 . . . . 0.089999999999999997 110.569 175.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.571 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.9 mt-30 -53.36 -44.06 68.27 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.524 -1.216 . . . . 1.2 112.182 176.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.684 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.2 mt-30 -62.95 -35.75 81.16 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.753 0.787 . . . . 2.3700000000000001 109.086 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.728 HG13 ' O ' ' A' ' 103' ' ' THR . 9.3 mt -74.43 -45.63 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-N 114.326 -1.307 . . . . 0.14999999999999999 111.417 -177.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.551 HD12 HD11 ' A' ' 48' ' ' LEU . 8.8 mt -63.8 -40.66 89.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.449 -0.341 . . . . 0.19 111.699 -177.242 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.7 t -56.31 -24.76 45.66 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.979 0.418 . . . . 1.1399999999999999 111.045 -178.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -65.65 -40.94 93.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.214 0.53 . . . . 1.6399999999999999 110.255 176.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -90.9 -16.78 27.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.635 -0.711 . . . . 0.65000000000000002 109.984 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.24 -39.08 82.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.135 -0.939 . . . . 0.76000000000000001 109.215 175.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -73.5 -38.3 65.41 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.539 -0.755 . . . . 2.27 109.782 174.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -92.55 52.07 1.84 Allowed 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 114.842 -1.072 . . . . 1.2 111.353 -175.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.539 -0.744 . . . . 2.7200000000000002 109.773 176.979 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.585 0 N-CA-C 111.774 -0.53 . . . . 19.890000000000001 111.774 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 10.2 t -152.74 107.39 2.7 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-O 120.726 0.298 . . . . 18.329999999999998 110.418 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.62 136.85 60.63 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 123.092 2.528 . . . . 17.390000000000001 111.787 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -176.18 174.97 47.3 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.616 -0.802 . . . . 16.359999999999999 112.343 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 523' ' ' TYR . . . . . 0.487 ' CE2' ' HB2' ' B' ' 525' ' ' ASN . 37.5 t80 -107.68 106.36 58.28 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.882 -0.414 . . . . 16.0 109.882 178.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.1 -44.92 6.48 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.883 2.389 . . . . 13.15 113.293 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 525' ' ' ASN . . . . . 0.487 ' HB2' ' CE2' ' B' ' 523' ' ' TYR . 7.8 t30 61.0 87.23 0.09 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.167 0.508 . . . . 12.359999999999999 110.847 -178.221 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 179.31 89.18 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.989 -0.624 . . . . 9.6300000000000008 111.663 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.95 76.61 6.65 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.289 0.566 . . . . 8.3399999999999999 110.638 -176.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 49.9 tp -109.79 62.75 0.6 Allowed 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 107.268 -1.382 . . . . 10.41 107.268 167.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 27.4 m 61.63 37.93 15.73 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 114.802 -1.09 . . . . 7.6200000000000001 108.149 -165.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -103.22 14.27 55.1 Favored Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 114.724 -1.125 . . . . 5.1900000000000004 113.555 -171.056 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -91.43 -22.56 20.38 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.804 1.287 . . . . 5.5 107.613 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -82.54 -5.19 58.61 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 112.787 -2.006 . . . . 5.6799999999999997 109.725 178.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -90.98 -18.72 24.19 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 113.928 -1.487 . . . . 3.2200000000000002 110.317 -177.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -70.61 -2.4 14.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.024 -0.534 . . . . 4.2699999999999996 110.828 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 13.6 p -66.02 -28.19 68.68 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.357 -0.608 . . . . 1.25 109.357 172.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 65.7 m -69.46 -31.81 70.35 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.353 -0.839 . . . . 2.0800000000000001 110.774 175.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 537' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' B' ' 537' ' ' ILE . 18.6 mm -82.68 -35.88 12.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.057 0.456 . . . . 1.29 110.438 176.091 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 538' ' ' ALA . . . . . 0.434 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -73.79 0.23 13.76 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.686 0.755 . . . . 0.76000000000000001 110.588 177.671 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 539' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -74.34 -41.99 60.16 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.924 -1.035 . . . . 1.23 109.018 171.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 46.5 mtm -67.14 -27.39 67.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.134 -0.939 . . . . 2.29 110.098 175.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 541' ' ' ASP . . . . . 0.434 ' HB2' ' HA ' ' B' ' 538' ' ' ALA . 0.8 OUTLIER -63.19 -53.71 48.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.605 -0.725 . . . . 1.1799999999999999 109.607 174.796 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.417 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -63.41 -35.05 79.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.81 -1.087 . . . . 0.56000000000000005 111.702 -173.593 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 34.7 m -60.76 -31.68 71.01 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 116.26 -0.427 . . . . 1.5800000000000001 111.788 -177.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -86.02 -27.33 24.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.033 0.444 . . . . 0.83999999999999997 110.505 178.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' B' ' 548' ' ' GLN . 86.4 mt -72.27 -32.75 66.92 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.591 -0.732 . . . . 1.0800000000000001 112.158 -177.096 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 20.3 mt -70.75 -27.6 64.07 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.474 0.654 . . . . 0.96999999999999997 109.608 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 17.1 t -81.13 -65.74 0.97 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.019 -0.991 . . . . 1.4199999999999999 110.29 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 548' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' B' ' 545' ' ' LEU . 14.0 mm100 49.12 47.87 21.51 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.49 0.662 . . . . 2.6699999999999999 111.034 -176.039 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 62.4 mt -113.64 -40.38 3.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 114.994 -1.003 . . . . 5.2300000000000004 109.269 176.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 27.9 m -128.0 67.85 1.34 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.321 -0.854 . . . . 6.4000000000000004 109.566 177.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 8.5 t . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.683 -0.675 . . . . 7.5899999999999999 109.745 -179.044 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo . . . . . 0 N--CA 1.479 0.626 0 N-CA-C 110.692 -0.542 . . . . 1.8899999999999999 110.692 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.6 t 59.69 74.46 0.44 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.462 0.648 . . . . 2.0499999999999998 111.451 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.424 ' CD2' HG21 ' A' ' 103' ' ' THR . 39.3 m80 -81.46 -7.71 59.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.651 -0.704 . . . . 0.75 110.17 174.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.0 p -143.79 168.23 20.43 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.967 0.413 . . . . 1.0900000000000001 111.541 -174.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.476 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 179.77 -159.01 23.18 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 110.824 -0.911 . . . . 0.16 110.824 -178.381 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.5 135.72 47.52 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 117.133 0.467 . . . . 0.16 110.176 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.542 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -151.68 140.78 21.22 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.043 0.386 . . . . 0.11 112.043 -177.139 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.751 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 87.0 mt -99.32 126.76 52.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.838 -0.43 . . . . 0.33000000000000002 109.838 173.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -125.95 135.19 51.57 Favored 'General case' 0 C--O 1.215 -0.731 0 N-CA-C 108.433 -0.951 . . . . 0.35999999999999999 108.433 178.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 57.98 26.04 12.97 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 122.68 0.392 . . . . 0.80000000000000004 110.754 -177.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm 69.46 1.04 3.15 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.876 0.695 . . . . 2.1099999999999999 112.876 -177.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.6 p -92.54 120.81 42.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 108.55 -0.907 . . . . 0.22 108.55 168.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.468 ' HA ' HG12 ' A' ' 8' ' ' ILE . 16.2 p -74.84 143.14 44.05 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.749 -0.66 . . . . 1.0700000000000001 111.266 -174.52 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.82 -158.59 9.79 Favored Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.461 -0.876 . . . . 0.11 113.436 -177.26 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.412 HG23 ' O ' ' A' ' 5' ' ' GLY . 20.4 mm -127.78 132.6 68.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 C-N-CA 123.396 0.679 . . . . 0.13 109.362 -176.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.505 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -101.61 135.41 38.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.903 -0.406 . . . . 0.13 109.903 -176.708 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.15 130.21 28.62 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.499 0.19 . . . . 0.10000000000000001 111.433 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.439 HD13 ' HB ' ' A' ' 103' ' ' THR . 53.8 mt -85.35 136.47 22.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.365 0.603 . . . . 0.27000000000000002 109.921 175.334 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -108.47 99.7 9.06 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.935 -1.03 . . . . 1.24 111.038 -173.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.511 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 23.8 mt-10 -112.31 171.14 7.69 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.421 -0.955 . . . . 1.2 108.421 174.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.511 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 33.7 t70 79.68 -6.37 1.8 Allowed 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 122.44 1.114 . . . . 0.57999999999999996 109.499 -177.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 23' ' ' SER . 23.4 m -103.53 -171.44 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 113.76 -1.564 . . . . 0.25 109.943 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.675 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.2 p -72.02 168.62 21.24 Favored Pre-proline 0 C--N 1.319 -0.737 0 N-CA-C 105.31 -2.107 . . . . 1.1299999999999999 105.31 174.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' PRO . . . . . 0.434 ' O ' HG13 ' A' ' 41' ' ' VAL . 72.8 Cg_exo -41.17 128.4 3.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 CA-C-N 121.594 1.605 . . . . 0.16 112.511 -146.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.539 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -49.2 139.9 10.41 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 114.195 -1.366 . . . . 0.10000000000000001 112.482 -164.104 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -121.69 168.96 11.19 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 114.687 -1.142 . . . . 0.32000000000000001 111.375 -170.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.887 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.99 107.02 13.54 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 107.141 -1.429 . . . . 0.089999999999999997 107.141 170.258 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.572 HG23 ' OG1' ' A' ' 39' ' ' THR . 3.3 m -103.84 106.51 17.04 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-O 120.795 0.331 . . . . 0.17000000000000001 110.875 -174.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.5 t90 -85.76 129.56 34.79 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 108.853 -0.795 . . . . 0.14000000000000001 108.853 172.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.562 ' HG2' HG23 ' A' ' 37' ' ' VAL . 97.9 mtt180 -124.97 157.43 36.12 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.871 -0.789 . . . . 1.9099999999999999 108.871 174.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -69.84 176.26 3.78 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.849 -0.426 . . . . 0.59999999999999998 109.849 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.2 p -61.45 -30.58 70.67 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.237 -0.585 . . . . 0.26000000000000001 111.258 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -94.94 -20.25 19.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.494 0.664 . . . . 2.1200000000000001 109.626 171.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 84.7 17.15 64.31 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 114.824 -1.08 . . . . 0.23000000000000001 112.635 177.328 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -67.38 -51.07 56.44 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.191 -0.67 . . . . 1.73 109.191 173.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -78.84 139.09 38.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.892 -0.781 . . . . 1.3 108.892 173.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.562 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.7 p -149.14 136.23 13.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 120.913 0.387 . . . . 0.17000000000000001 110.739 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -144.2 127.0 16.25 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.77 -0.456 . . . . 0.40999999999999998 109.77 177.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.572 ' OG1' HG23 ' A' ' 28' ' ' THR . 31.4 m -117.63 132.93 56.43 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.406 0.521 . . . . 0.14999999999999999 112.406 -172.52 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.887 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -99.88 129.45 50.49 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 107.93 -1.137 . . . . 0.12 107.93 168.422 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.434 HG13 ' O ' ' A' ' 24' ' ' PRO . 93.3 t -93.25 121.59 44.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 O-C-N 121.044 -1.035 . . . . 0.11 108.544 172.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.577 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -67.37 -21.24 65.62 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.32 0.859 . . . . 0.080000000000000002 113.32 -169.051 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.1 p -69.37 -13.74 62.53 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.223 -0.591 . . . . 0.87 109.673 175.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.431 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 3.8 p -110.75 11.79 22.55 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.384 -0.826 . . . . 0.14999999999999999 109.785 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.526 HG21 ' CD1' ' A' ' 62' ' ' LEU . 26.6 mm -110.75 140.76 28.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.071 -0.714 . . . . 0.12 109.071 177.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.411 ' HB2' ' HG2' ' A' ' 65' ' ' LYS . 38.8 t70 -104.8 -41.73 5.56 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.344 -0.389 . . . . 0.52000000000000002 110.934 -177.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.495 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 9.7 mtmm -140.82 171.73 13.68 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.768 0.318 . . . . 1.4099999999999999 111.247 -177.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.601 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -150.45 146.48 26.68 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.518 -0.919 . . . . 0.72999999999999998 108.518 177.622 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.584 ' HG3' HD11 ' A' ' 63' ' ' ILE . 0.5 OUTLIER -142.68 120.96 12.28 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 121.211 -0.195 . . . . 1.9399999999999999 110.943 -174.298 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.477 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -117.2 152.16 35.37 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.9 -0.5 . . . . 0.22 111.467 -179.116 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.544 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 70.5 p -77.64 119.53 77.78 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.884 -0.598 . . . . 0.26000000000000001 110.786 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.536 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 9.9 Cg_exo -60.7 165.47 11.63 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 122.711 2.274 . . . . 0.38 112.015 175.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.77 -21.29 63.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.146 0.498 . . . . 0.66000000000000003 110.692 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 70.6 m -78.91 -16.94 56.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.758 -0.655 . . . . 1.5 110.961 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.536 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 30.1 m -77.32 142.07 39.59 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.802 0.811 . . . . 0.84999999999999998 112.512 -177.06 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -55.4 -30.63 60.76 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 113.921 -1.49 . . . . 1.77 110.93 172.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.495 ' HB3' HG21 ' A' ' 51' ' ' THR . 3.0 mptp? -93.27 156.2 16.96 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 114.025 -1.443 . . . . 1.6299999999999999 111.966 -173.06 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.544 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 73.6 mmm -132.52 98.66 4.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.464 -0.789 . . . . 1.1100000000000001 109.206 168.754 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.495 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.0 OUTLIER -158.18 159.49 36.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.573 -0.74 . . . . 0.22 111.395 -170.286 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.6 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.5 tt -134.81 120.14 19.01 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.819 -0.808 . . . . 0.10000000000000001 108.819 177.609 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.689 ' NE ' ' HG2' ' A' ' 86' ' ' ARG . 1.9 mtp180 -105.33 146.46 29.35 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.1 0.476 . . . . 2.9900000000000002 111.787 -176.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.913 HD21 HD13 ' A' ' 104' ' ' LEU . 1.1 mm? -127.4 114.67 17.83 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.088 -0.96 . . . . 0.13 109.648 -177.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.584 HD11 ' HG3' ' A' ' 49' ' ' GLN . 1.8 mp -90.74 102.26 13.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 120.936 0.398 . . . . 0.28999999999999998 110.826 -172.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.488 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -70.56 137.0 26.79 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.732 -0.667 . . . . 0.54000000000000004 111.972 178.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.431 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 90.5 mttt -61.4 129.93 43.62 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.305 0.574 . . . . 0.55000000000000004 112.39 -175.259 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.655 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.4 t -121.11 144.5 29.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.23 -0.896 . . . . 1.73 110.163 171.655 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -77.78 88.44 4.01 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.708 -0.678 . . . . 3.23 109.416 176.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -76.14 -2.47 31.19 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.275 0.559 . . . . 2.3900000000000001 110.465 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 p -92.13 2.2 56.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.692 -0.686 . . . . 2.96 109.952 172.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.538 ' O ' ' HG3' ' A' ' 70' ' ' LYS . 4.3 ptmm? -90.57 20.56 4.52 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.588 -0.733 . . . . 2.4900000000000002 110.285 -178.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.2 mtmt -40.95 114.9 0.52 Allowed 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.765 0.793 . . . . 3.3999999999999999 111.031 -158.309 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 78.3 ttt180 -88.38 163.93 15.77 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.345 -1.298 . . . . 3.7999999999999998 109.131 -168.164 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 93.4 mttt -129.49 143.1 50.69 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.287 -0.634 . . . . 4.29 109.287 172.072 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 40.5 p30 -82.25 -167.43 1.57 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.301 -0.409 . . . . 4.4100000000000001 110.766 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -69.42 -20.47 63.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.776 0.322 . . . . 5.3399999999999999 111.56 -177.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.0 mt-10 -89.12 -28.17 20.25 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.039 0.447 . . . . 5.3799999999999999 109.966 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 109.89 16.99 10.01 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.97 -0.633 . . . . 4.3700000000000001 111.912 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.474 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 24.2 m120 -78.46 138.94 38.71 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.51 -0.552 . . . . 4.5099999999999998 109.51 178.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -70.15 102.03 1.99 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.29 -0.633 . . . . 4.2800000000000002 109.29 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.578 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 15.8 m -113.43 98.69 7.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-O 121.791 0.805 . . . . 3.1000000000000001 109.281 177.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.4 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 p -92.1 112.81 56.81 Favored Pre-proline 0 C--N 1.315 -0.903 0 CA-C-O 121.256 0.551 . . . . 2.5 110.154 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.492 ' HG2' ' HD3' ' A' ' 70' ' ' LYS . 87.9 Cg_exo -53.48 141.84 60.85 Favored 'Trans proline' 0 CA--C 1.518 -0.318 0 C-N-CA 123.683 2.922 . . . . 1.8700000000000001 112.985 -176.07 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -95.37 149.1 35.67 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 115.344 -0.844 . . . . 2.7400000000000002 109.674 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.655 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 27.4 Cg_exo -59.3 147.53 90.51 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.639 2.226 . . . . 0.83999999999999997 111.982 177.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -87.06 113.46 22.83 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 115.534 -0.757 . . . . 1.5700000000000001 109.361 -174.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.689 ' HG2' ' NE ' ' A' ' 61' ' ' ARG . 18.2 ttp180 -102.4 122.7 44.8 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.238 -0.892 . . . . 2.52 110.714 -171.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 74.9 m80 -92.8 155.87 17.37 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.12 -1.4 . . . . 0.71999999999999997 108.082 -175.409 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.495 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 28.0 ttm -141.02 140.16 34.26 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 118.278 0.49 . . . . 0.27000000000000002 110.586 174.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.542 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 13.4 m-85 -125.38 158.53 34.06 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 108.468 -0.938 . . . . 0.27000000000000002 108.468 171.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.751 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 5.2 p -99.12 160.42 14.28 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 109.136 -0.69 . . . . 1.26 109.136 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' PHE . . . . . 0.6 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 38.5 m-85 -145.87 162.82 36.86 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.156 0.503 . . . . 0.32000000000000001 111.746 176.056 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -123.08 0.5 9.08 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.486 -0.779 . . . . 2.3799999999999999 109.836 174.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.443 ' HB2' HG23 ' A' ' 96' ' ' VAL . 48.2 m-80 -146.85 126.82 13.63 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.661 -0.7 . . . . 1.1000000000000001 109.922 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.633 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.8 mmm180 -66.26 -38.59 88.19 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.184 -0.462 . . . . 3.0899999999999999 111.584 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.3 m -62.45 -24.22 67.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.05 0.453 . . . . 0.34999999999999998 110.505 -175.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.624 ' O ' HG12 ' A' ' 100' ' ' ILE . 11.9 t -76.14 -59.58 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 N-CA-C 109.537 -0.542 . . . . 0.23000000000000001 109.537 173.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.633 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.2 ptp -58.23 -41.78 84.86 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.602 -0.272 . . . . 0.17000000000000001 111.161 -176.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.518 ' N ' ' HG3' ' A' ' 97' ' ' MET . 32.4 t70 -60.61 -40.81 93.2 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.097 -0.641 . . . . 0.34000000000000002 110.39 177.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 14.0 m-20 -74.12 -40.91 62.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.177 -0.465 . . . . 1.3600000000000001 111.744 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 96' ' ' VAL . 34.4 mm -61.08 -56.96 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.333 0 N-CA-C 108.51 -0.922 . . . . 0.12 108.51 175.196 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.799 ' HA ' HD12 ' A' ' 104' ' ' LEU . 30.0 ttpt -50.96 -50.17 58.62 Favored 'General case' 0 C--O 1.216 -0.674 0 O-C-N 124.033 0.833 . . . . 0.79000000000000004 109.72 177.041 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.494 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.5 ttp -49.91 -55.31 14.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.757 -0.656 . . . . 0.28000000000000003 111.273 178.212 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.728 ' O ' HG13 ' A' ' 107' ' ' ILE . 53.6 m -57.44 -54.58 45.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.136 -0.484 . . . . 0.17999999999999999 110.353 178.45 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.913 HD13 HD21 ' A' ' 62' ' ' LEU . 26.8 mt -46.97 -56.13 6.94 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 123.333 0.653 . . . . 0.089999999999999997 110.714 176.316 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.55 ' HG2' HD13 ' A' ' 48' ' ' LEU . 60.0 mt-30 -49.47 -47.43 48.45 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.693 -1.139 . . . . 1.2 112.032 177.382 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 102' ' ' MET . 82.7 mm-40 -65.99 -36.78 84.23 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.786 0.803 . . . . 2.3700000000000001 109.903 -177.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.728 HG13 ' O ' ' A' ' 103' ' ' THR . 8.3 mt -69.12 -44.38 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 CA-C-N 114.526 -1.216 . . . . 0.14999999999999999 110.721 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.0 mt -64.56 -43.51 96.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.188 -0.46 . . . . 0.19 111.315 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.7 t -55.05 -28.51 52.81 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.213 0.32 . . . . 1.1399999999999999 111.144 -178.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 106' ' ' GLN . 91.8 mtt180 -60.5 -51.02 71.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.482 0.658 . . . . 1.6399999999999999 109.671 175.099 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -80.88 -15.13 57.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.339 -0.846 . . . . 0.65000000000000002 110.468 -179.041 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -37.09 78.45 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.074 -0.713 . . . . 0.76000000000000001 109.074 175.743 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -72.52 -37.83 68.23 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.382 -0.826 . . . . 2.27 109.868 173.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -92.59 51.94 1.81 Allowed 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 115.103 -0.953 . . . . 1.2 110.757 -176.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.376 -0.821 . . . . 2.7200000000000002 110.641 -177.302 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 111.843 -0.503 . . . . 19.890000000000001 111.843 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 45.8 m -127.12 88.93 53.14 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-O 120.802 0.334 . . . . 18.329999999999998 111.06 -178.231 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -79.33 176.25 9.88 Favored 'Trans proline' 0 C--O 1.237 0.461 0 C-N-CA 122.888 2.392 . . . . 17.390000000000001 112.22 178.042 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 68.38 32.11 75.13 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 121.054 -0.593 . . . . 16.359999999999999 111.977 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -158.12 121.49 2.12 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 110.043 -0.355 . . . . 16.0 110.043 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -79.89 -171.37 1.23 Allowed 'Trans proline' 0 N--CA 1.463 -0.287 0 C-N-CA 122.716 2.277 . . . . 13.15 112.435 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -72.02 -56.77 5.06 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.903 0.383 . . . . 12.359999999999999 110.388 179.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -121.35 -169.93 13.82 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.92 -0.657 . . . . 9.6300000000000008 112.151 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.4 ' C ' ' H ' ' B' ' 529' ' ' SER . 1.1 pt? -117.8 14.7 14.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.862 0.363 . . . . 8.3399999999999999 111.037 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 62.1 mt -77.71 27.75 0.17 Allowed 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.059 -0.518 . . . . 10.41 111.874 -175.317 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 529' ' ' SER . . . . . 0.4 ' H ' ' C ' ' B' ' 527' ' ' LEU . 37.6 t -148.5 17.18 1.03 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.333 -0.618 . . . . 7.6200000000000001 109.333 175.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -76.08 -83.11 0.47 Allowed Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.68 -0.691 . . . . 5.1900000000000004 112.397 -176.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -139.2 -17.44 1.03 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.265 0.555 . . . . 5.5 111.341 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -89.01 -7.32 56.18 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.047 0.927 . . . . 5.6799999999999997 110.039 -177.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -74.05 -32.2 63.21 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 114.104 -1.407 . . . . 3.2200000000000002 109.856 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -69.34 -31.35 69.73 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.53 -0.759 . . . . 4.2699999999999996 110.81 -178.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 535' ' ' SER . . . . . 0.404 ' HA ' ' HB3' ' B' ' 538' ' ' ALA . 1.2 p -85.66 -15.43 42.41 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.136 -0.484 . . . . 1.25 110.654 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 536' ' ' SER . . . . . 0.473 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 50.3 m -81.51 -37.46 27.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.941 -0.572 . . . . 2.0800000000000001 110.014 174.114 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 25.1 mm -72.87 -33.82 44.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.382 0.61 . . . . 1.29 109.674 172.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 538' ' ' ALA . . . . . 0.417 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -80.96 13.28 2.78 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.671 0.748 . . . . 0.76000000000000001 110.422 174.106 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.504 ' HA ' ' NH1' ' A' ' 61' ' ' ARG . 21.6 t70 -94.39 -43.6 8.31 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.26 -0.882 . . . . 1.23 108.769 173.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 4.7 mpp? -64.65 -22.62 67.02 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.578 -0.737 . . . . 2.29 109.713 169.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 541' ' ' ASP . . . . . 0.455 ' OD2' ' HE3' ' A' ' 57' ' ' LYS . 33.9 t70 -59.73 -46.16 89.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.194 -0.912 . . . . 1.1799999999999999 110.774 175.386 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.566 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.4 OUTLIER -71.71 -31.13 66.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.457 -0.792 . . . . 0.56000000000000005 112.048 -169.28 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -44.59 97.08 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-O 121.064 0.459 . . . . 1.5800000000000001 110.729 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -77.13 -24.05 51.67 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.082 -0.508 . . . . 0.83999999999999997 110.172 176.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -64.39 -45.53 87.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.48 -0.782 . . . . 1.0800000000000001 111.374 -178.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 546' ' ' LEU . . . . . 0.552 HD11 ' HB3' ' A' ' 49' ' ' GLN . 96.0 mt -75.39 -35.99 60.97 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.325 0.583 . . . . 0.96999999999999997 110.256 178.007 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 51.7 m -60.51 -73.65 0.09 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.804 -1.089 . . . . 1.4199999999999999 111.146 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 49.02 38.08 11.82 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.116 0.484 . . . . 2.6699999999999999 111.447 -177.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 19.2 pt -106.96 -33.52 2.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.98 -0.555 . . . . 5.2300000000000004 110.676 -177.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 9.0 t 53.85 54.66 9.48 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 109.77 -0.456 . . . . 6.4000000000000004 109.77 -178.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 8.1 t . . . . . 0 C--O 1.25 1.096 0 CA-C-N 115.201 -0.909 . . . . 7.5899999999999999 110.159 -176.298 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.467 ' HB2' ' OD1' ' A' ' 99' ' ' ASN . 15.0 Cg_exo . . . . . 0 N--CA 1.479 0.674 0 N-CA-C 111.011 -0.419 . . . . 1.8899999999999999 111.011 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.495 ' O ' ' HB3' ' A' ' 99' ' ' ASN . 22.9 t -162.96 95.22 0.86 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.307 0.575 . . . . 2.0499999999999998 110.461 177.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.594 ' HB2' HD12 ' A' ' 18' ' ' ILE . 22.4 p-80 -107.72 31.31 5.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.829 0.823 . . . . 0.75 109.412 173.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 55.0 p -160.46 148.25 16.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.09 -0.959 . . . . 1.0900000000000001 110.584 171.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.421 ' O ' HG23 ' A' ' 15' ' ' ILE . . . -175.21 -153.81 10.58 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.105 -0.798 . . . . 0.16 111.105 -177.0 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.63 140.28 38.26 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 117.09 0.445 . . . . 0.16 110.001 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.453 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -152.04 144.36 24.02 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.071 0.462 . . . . 0.11 111.506 -178.505 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.576 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 81.8 mt -109.75 106.59 21.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.063 -0.517 . . . . 0.33000000000000002 110.415 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -106.3 138.65 42.1 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 108.762 -0.829 . . . . 0.35999999999999999 108.762 -178.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 53.66 22.17 2.96 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.912 0.485 . . . . 0.80000000000000004 111.504 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt 66.97 16.84 10.44 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.906 -0.588 . . . . 2.1099999999999999 111.724 -178.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.438 HG13 ' CH2' ' A' ' 29' ' ' TRP . 2.3 p -102.52 117.35 47.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 107.467 -1.309 . . . . 0.22 107.467 163.429 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -74.4 145.32 43.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.994 0.425 . . . . 1.0700000000000001 111.093 -172.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -166.49 -159.38 12.17 Favored Glycine 0 N--CA 1.437 -1.299 0 C-N-CA 120.111 -1.043 . . . . 0.11 113.408 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.421 HG23 ' O ' ' A' ' 5' ' ' GLY . 14.7 mm -124.89 132.09 71.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 114.94 -0.63 . . . . 0.13 109.475 -176.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.531 HD11 HD11 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -101.24 134.16 42.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.794 -0.447 . . . . 0.13 109.794 -177.696 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.29 124.37 22.95 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.364 -0.38 . . . . 0.10000000000000001 110.933 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ILE . . . . . 0.634 HG12 HD23 ' A' ' 27' ' ' LEU . 22.8 mt -84.58 127.17 40.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.385 -0.598 . . . . 0.27000000000000002 109.385 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -97.7 101.87 13.48 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.864 -0.607 . . . . 1.24 110.533 -173.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -116.41 169.05 9.61 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.136 -0.69 . . . . 1.2 109.136 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.9 t70 75.92 -1.63 2.93 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 122.151 0.977 . . . . 0.57999999999999996 109.971 -177.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 23' ' ' SER . 32.7 m -103.06 -173.89 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 114.249 -1.341 . . . . 0.25 109.848 179.223 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.635 ' O ' HG23 ' A' ' 22' ' ' VAL . 47.8 m -72.92 167.51 33.28 Favored Pre-proline 0 C--N 1.319 -0.753 0 N-CA-C 105.157 -2.164 . . . . 1.1299999999999999 105.157 173.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -41.53 126.82 3.15 Favored 'Trans proline' 0 C--N 1.357 0.974 0 CA-C-N 121.413 1.54 . . . . 0.16 112.27 -140.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -51.35 140.76 16.6 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-N 114.227 -1.351 . . . . 0.10000000000000001 112.371 -165.484 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -124.33 169.13 12.1 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 114.126 -1.397 . . . . 0.32000000000000001 111.506 -169.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.68 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -117.32 104.61 11.32 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.471 -1.307 . . . . 0.089999999999999997 107.471 173.499 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.428 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.6 m -100.07 106.16 17.88 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 120.795 -0.362 . . . . 0.17000000000000001 110.593 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.438 ' CH2' HG13 ' A' ' 12' ' ' VAL . 81.6 t90 -87.07 131.48 34.11 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.697 -0.853 . . . . 0.14000000000000001 108.697 171.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.501 ' HG2' HG23 ' A' ' 37' ' ' VAL . 72.3 mtt180 -126.01 158.58 34.96 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.969 -0.752 . . . . 1.9099999999999999 108.969 174.402 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.9 p -68.42 173.11 5.2 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.789 -0.819 . . . . 0.59999999999999998 108.789 177.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -56.17 -40.67 74.25 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.572 -0.451 . . . . 0.26000000000000001 111.398 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -87.83 -22.91 24.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.581 0.705 . . . . 2.1200000000000001 109.824 173.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.449 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 92.73 16.84 47.1 Favored Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 114.964 -1.016 . . . . 0.23000000000000001 112.481 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -59.83 -51.8 68.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.293 0.568 . . . . 1.73 109.52 173.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -88.29 144.01 26.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.306 -0.861 . . . . 1.3 109.24 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' VAL . . . . . 0.501 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.6 p -149.3 138.12 15.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.806 0.336 . . . . 0.17000000000000001 110.941 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -144.09 121.46 11.65 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.645 -0.502 . . . . 0.40999999999999998 109.645 177.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 48.1 m -110.79 130.47 55.57 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 111.955 0.354 . . . . 0.14999999999999999 111.955 -175.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.68 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -99.56 129.76 49.62 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.77 0 N-CA-C 108.253 -1.018 . . . . 0.12 108.253 169.996 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.426 ' O ' HG12 ' A' ' 45' ' ' ILE . 64.5 t -92.79 119.03 39.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 O-C-N 121.144 -0.973 . . . . 0.11 108.875 173.241 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.546 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -67.25 -16.47 64.3 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 112.47 0.545 . . . . 0.080000000000000002 112.47 -171.202 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.532 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 96.8 p -71.66 -14.36 62.02 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.26 -0.644 . . . . 0.87 109.26 176.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.3 p -110.1 6.6 22.99 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.321 -0.854 . . . . 0.14999999999999999 109.871 -179.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.509 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 27.9 mm -107.83 141.33 23.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.652 -0.704 . . . . 0.12 109.268 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -99.29 -45.42 5.88 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.249 -0.432 . . . . 0.52000000000000002 110.449 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.522 ' C ' HD22 ' A' ' 48' ' ' LEU . 10.5 mtmm -141.86 174.05 10.94 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.372 0.606 . . . . 1.4099999999999999 111.83 -175.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.768 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -137.56 152.59 49.6 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 107.261 -1.385 . . . . 0.72999999999999998 107.261 174.488 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.423 ' HG2' HD11 ' A' ' 63' ' ' ILE . 15.7 mm-40 -144.05 118.95 9.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.298 0.499 . . . . 1.9399999999999999 110.618 179.038 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.51 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -116.67 141.57 48.02 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 122.195 -0.316 . . . . 0.22 111.444 -178.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.425 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 81.3 p -68.74 119.78 71.39 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 115.952 -0.567 . . . . 0.26000000000000001 110.753 -175.351 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.529 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 7.7 Cg_exo -60.56 163.43 15.45 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.646 2.231 . . . . 0.38 112.125 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.01 -21.73 66.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.707 -0.679 . . . . 0.66000000000000003 111.576 -177.211 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.9 m -96.51 6.31 48.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.009 -0.541 . . . . 1.5 110.673 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.529 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 42.7 m -89.62 145.52 25.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.009 -0.541 . . . . 0.84999999999999998 110.839 174.182 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -53.73 -23.39 11.57 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 114.935 -1.03 . . . . 1.77 111.666 175.799 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.627 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 43.2 mmtm -105.2 161.53 14.19 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 114.326 -1.306 . . . . 1.6299999999999999 112.397 -164.228 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.435 ' HB3' ' HE3' ' A' ' 58' ' ' MET . 83.9 mmm -131.68 97.21 4.15 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.847 -1.07 . . . . 1.1100000000000001 108.528 166.529 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.627 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.2 OUTLIER -154.14 157.37 38.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.191 0.519 . . . . 0.22 111.676 -172.99 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.7 tt -133.63 119.59 19.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.478 -0.934 . . . . 0.10000000000000001 108.478 177.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.58 ' HG2' ' HB2' ' A' ' 88' ' ' MET . 8.4 mtp180 -103.88 140.88 37.06 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.219 0.533 . . . . 2.9900000000000002 111.552 -178.431 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.98 HD21 HD13 ' A' ' 104' ' ' LEU . 1.8 mm? -115.36 111.52 20.97 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.935 -1.029 . . . . 0.13 109.599 176.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ILE . . . . . 0.556 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -91.71 98.35 8.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.354 -0.384 . . . . 0.28999999999999998 110.519 -169.59 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.479 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -68.18 144.23 42.54 Favored Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.666 -0.697 . . . . 0.54000000000000004 112.039 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.509 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 81.5 mttt -64.06 126.06 26.47 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 113.213 0.82 . . . . 0.55000000000000004 113.213 -173.669 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.623 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 0.9 OUTLIER -120.78 143.47 32.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 114.565 -1.198 . . . . 1.73 109.916 171.957 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.728 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 22.7 t70 -86.59 83.06 7.7 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.175 -0.676 . . . . 3.23 109.175 177.472 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -62.8 -6.71 3.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.621 0.6 . . . . 2.3900000000000001 112.621 -170.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -77.07 -4.08 42.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.069 0.462 . . . . 2.96 110.757 172.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.728 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.0 ptmt -82.2 41.93 0.71 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.852 -0.613 . . . . 2.4900000000000002 110.326 175.014 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.577 ' HE2' ' OE1' ' A' ' 79' ' ' GLU . 23.5 mmtm -44.49 115.11 0.79 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.594 -0.73 . . . . 3.3999999999999999 110.437 -176.295 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.665 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 77.7 ttt180 -95.68 165.87 12.1 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 107.708 -1.219 . . . . 3.7999999999999998 107.708 -176.321 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -128.6 131.95 48.16 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 118.904 0.775 . . . . 4.29 111.215 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -73.21 172.14 11.68 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.449 -1.25 . . . . 4.4100000000000001 110.236 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -51.79 -31.54 27.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.955 0.407 . . . . 5.3399999999999999 111.405 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -94.18 15.87 16.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.38 -0.373 . . . . 5.3799999999999999 111.694 -176.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.51 11.77 80.18 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.348 -0.387 . . . . 4.3700000000000001 113.016 176.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -73.51 131.9 42.28 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.244 -0.651 . . . . 4.5099999999999998 109.244 176.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.577 ' OE1' ' HE2' ' A' ' 71' ' ' LYS . 26.8 tt0 -68.09 95.28 0.55 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.61 -0.515 . . . . 4.2800000000000002 109.61 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' VAL . . . . . 0.665 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 10.8 m -102.5 99.46 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 CA-C-O 121.732 0.777 . . . . 3.1000000000000001 109.277 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.532 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.1 p -82.61 117.76 69.58 Favored Pre-proline 0 C--N 1.308 -1.239 0 CA-C-N 115.704 -0.68 . . . . 2.5 109.776 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.545 ' HG2' ' HE2' ' A' ' 70' ' ' LYS . 52.9 Cg_exo -54.95 138.88 78.96 Favored 'Trans proline' 0 CA--C 1.511 -0.653 0 C-N-CA 123.282 2.655 . . . . 1.8700000000000001 112.725 -174.445 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.9 mmmm -82.04 140.03 46.21 Favored Pre-proline 0 N--CA 1.422 -1.868 0 CA-C-N 115.212 -0.904 . . . . 2.7400000000000002 110.936 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.623 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 26.5 Cg_exo -59.35 146.52 94.55 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.391 2.061 . . . . 0.83999999999999997 110.588 175.337 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -78.04 113.97 16.48 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.508 0.67 . . . . 1.5700000000000001 109.951 -173.004 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.445 ' HG2' HG13 ' A' ' 63' ' ' ILE . 97.2 mtt180 -107.27 121.01 43.69 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 115.379 -0.828 . . . . 2.52 110.738 -171.237 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' HIS . . . . . 0.58 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 58.2 m-70 -94.55 110.87 22.64 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.598 -0.89 . . . . 0.71999999999999997 108.598 -176.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.58 ' HB2' ' HG2' ' A' ' 61' ' ' ARG . 20.1 ttm -108.4 122.1 46.3 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 119.736 -0.786 . . . . 0.27000000000000002 111.654 -175.154 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.453 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 5.9 m-85 -112.08 130.75 55.78 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.035 -0.984 . . . . 0.27000000000000002 109.65 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' SER . . . . . 0.576 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -80.99 151.6 28.39 Favored 'General case' 0 C--N 1.316 -0.886 0 O-C-N 122.035 -0.415 . . . . 1.26 110.526 177.122 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -133.52 174.39 10.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.231 -0.441 . . . . 0.32000000000000001 111.149 -175.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -115.71 -22.16 9.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.547 -0.751 . . . . 2.3799999999999999 111.032 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -141.37 142.29 33.78 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.969 0.414 . . . . 1.1000000000000001 110.528 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.655 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.0 mmm180 -67.61 -33.22 74.54 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.581 -0.736 . . . . 3.0899999999999999 111.326 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.6 m -59.9 -38.75 83.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.17 -0.468 . . . . 0.34999999999999998 110.512 -175.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.573 ' O ' HG12 ' A' ' 100' ' ' ILE . 6.6 t -67.71 -56.06 14.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.19 -0.459 . . . . 0.23000000000000001 109.952 177.416 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' MET . . . . . 0.655 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.4 ptp -60.12 -41.09 91.88 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.422 -0.354 . . . . 0.17000000000000001 111.2 -177.016 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.463 ' N ' ' HG3' ' A' ' 97' ' ' MET . 24.6 t70 -61.96 -39.04 90.78 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 120.0 -0.68 . . . . 0.34000000000000002 110.534 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.495 ' HB3' ' O ' ' A' ' 2' ' ' SER . 7.7 m-80 -72.96 -43.92 61.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.38 -0.373 . . . . 1.3600000000000001 111.393 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.613 HG22 HD11 ' A' ' 104' ' ' LEU . 33.2 mm -60.49 -56.02 20.51 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 N-CA-C 108.703 -0.851 . . . . 0.12 108.703 176.101 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.911 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.4 ttpt -52.43 -48.35 65.81 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 115.403 -0.817 . . . . 0.79000000000000004 109.836 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.695 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 32.3 ttp -47.56 -59.47 3.23 Favored 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 123.812 0.695 . . . . 0.28000000000000003 111.099 176.511 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' THR . . . . . 0.78 ' O ' HG13 ' A' ' 107' ' ' ILE . 24.3 m -56.41 -50.43 71.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.939 -0.573 . . . . 0.17999999999999999 110.227 -178.628 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.98 HD13 HD21 ' A' ' 62' ' ' LEU . 25.8 mt -49.0 -56.15 9.82 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 121.342 0.591 . . . . 0.089999999999999997 110.232 175.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.768 ' HG2' HD23 ' A' ' 48' ' ' LEU . 27.8 mt-30 -52.18 -43.12 64.0 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.778 -1.101 . . . . 1.2 112.177 176.475 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' A' ' 102' ' ' MET . 84.5 mt-30 -66.07 -38.95 89.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 122.035 0.922 . . . . 2.3700000000000001 109.013 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ILE . . . . . 0.78 HG13 ' O ' ' A' ' 103' ' ' THR . 7.8 mt -72.73 -45.57 56.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 114.196 -1.365 . . . . 0.14999999999999999 111.531 -177.476 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ILE . . . . . 0.591 HG13 ' O ' ' A' ' 104' ' ' LEU . 19.1 mt -58.67 -44.07 89.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 112.226 0.454 . . . . 0.19 112.226 -176.502 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' SER . . . . . 0.65 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 12.6 t -66.49 -15.69 63.56 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.776 -0.37 . . . . 1.1399999999999999 111.865 -176.938 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -59.42 -35.5 74.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.619 0.723 . . . . 1.6399999999999999 109.129 168.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.532 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 33.7 m-85 -97.14 -16.93 20.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.905 -1.043 . . . . 0.65000000000000002 110.61 -177.541 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LYS . . . . . 0.65 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 9.1 mmpt? -68.49 -26.52 65.51 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.155 -0.684 . . . . 0.76000000000000001 109.155 172.157 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.0 0.19 56.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.36 -0.836 . . . . 2.27 110.486 173.794 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -134.97 56.47 1.85 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.844 -0.616 . . . . 1.2 111.083 -178.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.305 -0.855 . . . . 2.7200000000000002 109.789 178.842 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.655 0 N-CA-C 111.968 -0.453 . . . . 19.890000000000001 111.968 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 23.2 t -141.37 75.75 22.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 120.909 0.385 . . . . 18.329999999999998 110.298 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -89.18 38.53 0.42 Allowed 'Trans proline' 0 CA--C 1.531 0.335 0 C-N-CA 123.095 2.53 . . . . 17.390000000000001 112.718 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 67.79 48.45 55.25 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.751 -0.738 . . . . 16.359999999999999 111.702 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -107.67 123.29 38.37 Favored Pre-proline 0 C--N 1.32 -0.699 0 N-CA-C 110.476 -0.194 . . . . 16.0 110.476 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -61.11 150.33 84.88 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.73 2.287 . . . . 13.15 111.18 175.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -55.03 101.38 0.05 OUTLIER 'General case' 0 C--O 1.234 0.279 0 O-C-N 123.367 0.417 . . . . 12.359999999999999 111.023 -179.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -87.88 82.77 1.55 Allowed Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.74 -0.664 . . . . 9.6300000000000008 111.573 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 527' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' B' ' 530' ' ' GLY . 0.5 OUTLIER -78.21 33.72 0.19 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.154 0.502 . . . . 8.3399999999999999 111.619 -178.003 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 528' ' ' LEU . . . . . 0.437 HD23 ' O ' ' B' ' 528' ' ' LEU . 10.4 tt -65.06 -18.38 65.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.732 0.777 . . . . 10.41 109.414 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 5.4 p -130.45 13.77 5.51 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.871 -1.059 . . . . 7.6200000000000001 109.495 178.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 530' ' ' GLY . . . . . 0.501 ' O ' ' HB2' ' B' ' 527' ' ' LEU . . . -140.05 49.18 0.81 Allowed Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 114.849 -1.069 . . . . 5.1900000000000004 110.887 -178.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -97.46 -4.35 38.27 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 122.605 1.193 . . . . 5.5 108.053 -172.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -91.33 -9.57 44.48 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.608 -1.633 . . . . 5.6799999999999997 109.549 174.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -85.21 -26.49 26.71 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.834 -1.53 . . . . 3.2200000000000002 111.987 -172.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -65.44 -16.83 64.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.445 0.64 . . . . 4.2699999999999996 110.405 -177.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 535' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' B' ' 539' ' ' ASP . 96.5 p -73.41 -12.75 60.91 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.486 -0.779 . . . . 1.25 110.624 -177.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 26.0 m -75.95 -37.07 59.04 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.121 0.486 . . . . 2.0800000000000001 110.289 175.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 41.3 mm -78.43 -37.82 22.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.249 0.547 . . . . 1.29 109.642 175.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -76.51 4.26 9.57 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.667 0.746 . . . . 0.76000000000000001 110.486 175.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 539' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' B' ' 535' ' ' SER . 30.7 t70 -89.4 -46.94 8.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.104 -0.953 . . . . 1.23 109.17 173.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 42.0 mtm -60.33 -32.96 71.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.772 -1.103 . . . . 2.29 109.895 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 541' ' ' ASP . . . . . 0.446 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 2.2 t70 -55.13 -47.15 75.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.394 -0.821 . . . . 1.1799999999999999 109.852 173.357 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 542' ' ' PHE . . . . . 0.435 ' HA ' HD12 ' B' ' 545' ' ' LEU . 0.1 OUTLIER -68.76 -35.12 76.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.241 -0.89 . . . . 0.56000000000000005 110.988 -175.834 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 25.9 t -61.48 -36.65 81.06 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.181 -0.463 . . . . 1.5800000000000001 110.197 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -84.68 -8.61 58.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.064 -0.516 . . . . 0.83999999999999997 111.077 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 545' ' ' LEU . . . . . 0.573 ' O ' ' HG3' ' B' ' 548' ' ' GLN . 61.8 mt -88.27 -42.36 12.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.878 0.37 . . . . 1.0800000000000001 111.811 178.257 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 25.9 mt -74.38 -26.0 59.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.65 0.738 . . . . 0.96999999999999997 109.368 176.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 15.4 t -121.37 70.68 0.94 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.678 -1.146 . . . . 1.4199999999999999 109.739 176.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 548' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' B' ' 545' ' ' LEU . 49.1 mt-30 -83.66 45.57 1.08 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.076 -0.511 . . . . 2.6699999999999999 110.866 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 22.5 mt 54.24 60.84 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-O 121.667 0.746 . . . . 5.2300000000000004 109.628 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 23.3 t -142.8 74.31 1.44 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.438 -0.801 . . . . 6.4000000000000004 109.826 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.275 -0.869 . . . . 7.5899999999999999 110.097 179.711 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.564 ' HA ' HD12 ' A' ' 18' ' ' ILE . 76.5 m80 . . . . . 0 N--CA 1.473 0.722 0 N-CA-C 112.217 0.451 . . . . 0.75 112.217 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.1 p -147.77 161.59 40.94 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 119.807 -0.757 . . . . 1.09 112.212 -177.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.45 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -177.82 -166.21 34.01 Favored Glycine 0 N--CA 1.44 -1.063 0 CA-C-N 114.803 -1.089 . . . . 0.16 110.413 -178.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.16 132.98 44.08 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 117.432 0.616 . . . . 0.16 110.241 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.482 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -144.58 145.51 31.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.952 0.406 . . . . 0.11 111.578 -176.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.468 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 84.4 mt -110.84 111.05 34.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.26 -0.427 . . . . 0.33 110.246 178.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -112.51 137.33 50.89 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.714 -0.847 . . . . 0.36 108.714 -178.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 57.1 23.28 8.31 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.966 0.412 . . . . 0.8 110.479 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt 68.6 6.48 5.48 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.237 -0.892 . . . . 2.11 112.741 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.401 HG13 ' CH2' ' A' ' 29' ' ' TRP . 1.5 p -94.04 122.16 45.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 108.025 -1.102 . . . . 0.22 108.025 166.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.9 p -76.21 142.49 41.47 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.896 0.379 . . . . 1.07 111.293 -173.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.463 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -160.72 -157.72 8.88 Favored Glycine 0 N--CA 1.437 -1.282 0 C-N-CA 120.325 -0.941 . . . . 0.11 113.083 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 24.6 mm -126.66 135.58 63.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.095 -0.706 . . . . 0.13 109.095 -178.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.532 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.27 135.84 40.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.972 -0.381 . . . . 0.13 109.972 -176.428 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.98 126.71 25.5 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.846 0.355 . . . . 0.1 111.642 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.564 HD12 ' HA ' ' A' ' 3' ' ' HIS . 71.0 mt -85.24 134.38 27.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.023 0.439 . . . . 0.27 109.988 177.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -105.49 102.22 11.7 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.806 -0.633 . . . . 1.24 110.847 -175.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 23.9 mt-10 -116.66 169.68 9.17 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.166 -0.679 . . . . 1.2 109.166 174.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 26.6 t0 77.5 -1.32 2.71 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.474 1.131 . . . . 0.58 109.513 -175.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 23' ' ' SER . 30.0 m -104.56 -174.67 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 113.762 -1.563 . . . . 0.25 109.766 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.618 ' O ' HG23 ' A' ' 22' ' ' VAL . 43.1 m -73.59 169.46 18.34 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 105.46 -2.052 . . . . 1.13 105.46 174.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo -41.77 128.62 3.83 Favored 'Trans proline' 0 C--N 1.359 1.08 0 CA-C-N 121.624 1.616 . . . . 0.16 112.095 -143.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.483 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -55.77 143.1 32.17 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 114.194 -1.367 . . . . 0.1 112.198 -161.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.99 167.83 14.77 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 114.715 -1.129 . . . . 0.32 111.92 -170.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.66 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -118.09 107.86 14.51 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.627 -1.249 . . . . 0.09 107.627 175.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 m -102.97 106.5 17.04 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.772 0.32 . . . . 0.17 110.875 -175.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.401 ' CH2' HG13 ' A' ' 12' ' ' VAL . 84.4 t90 -87.16 131.8 34.06 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.888 -0.782 . . . . 0.14 108.888 171.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.466 ' HG2' HG23 ' A' ' 37' ' ' VAL . 60.0 mtt180 -126.36 157.88 37.31 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.918 -0.771 . . . . 1.91 108.918 174.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -67.12 172.79 4.26 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.184 -0.673 . . . . 0.6 109.184 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.463 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.2 p -57.59 -32.36 67.09 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.323 -0.551 . . . . 0.26 111.242 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -93.58 -32.18 14.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.581 0.705 . . . . 2.12 109.546 172.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.443 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 99.59 17.39 26.36 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 114.921 -1.036 . . . . 0.23 112.693 177.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.82 -29.37 66.63 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.269 0.557 . . . . 1.73 109.743 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -103.1 141.2 36.24 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.536 -0.912 . . . . 1.3 108.536 173.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.466 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.0 p -149.98 140.39 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.719 -0.392 . . . . 0.17 111.489 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -144.47 125.45 14.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.435 . . . . 0.41 109.969 177.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 26.4 m -111.21 133.48 53.52 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 111.876 0.324 . . . . 0.15 111.876 -175.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.66 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.08 127.73 58.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.297 -1.001 . . . . 0.12 108.297 168.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.2 t -92.25 119.19 39.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 O-C-N 121.11 -0.994 . . . . 0.11 108.863 173.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.612 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.28 -16.58 64.01 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.433 0.531 . . . . 0.08 112.433 -170.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.557 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 92.9 p -70.03 -14.8 62.85 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.32 -0.622 . . . . 0.87 109.32 175.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.3 p -112.76 11.13 19.33 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.103 -0.953 . . . . 0.15 110.188 -178.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.544 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 26.7 mm -108.13 139.84 28.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.5 -0.555 . . . . 0.12 109.5 178.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -102.13 -43.83 5.62 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.194 -0.457 . . . . 0.52 110.604 -177.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.1 mtmm -139.58 171.75 13.79 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.069 0.461 . . . . 1.41 110.867 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.728 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -150.31 151.95 33.71 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.383 -0.969 . . . . 0.73 108.383 178.482 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.487 ' HG3' HD11 ' A' ' 63' ' ' ILE . 2.3 mt-30 -139.02 145.98 40.3 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 109.777 -0.453 . . . . 1.94 109.777 -177.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.537 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -137.74 132.81 33.32 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 122.09 -0.381 . . . . 0.22 110.24 174.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.471 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 64.1 p -60.18 118.62 34.85 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.74 -0.664 . . . . 0.26 110.803 -176.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.451 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 24.6 Cg_exo -54.61 159.75 8.25 Favored 'Trans proline' 0 N--CA 1.464 -0.214 0 C-N-CA 122.776 2.318 . . . . 0.38 112.191 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.82 -21.27 66.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.011 -0.54 . . . . 0.66 111.007 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.2 p -83.42 -16.72 44.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.964 -0.562 . . . . 1.5 111.05 176.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.451 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 56.0 m -77.3 134.77 38.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.919 -0.582 . . . . 0.85 111.323 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -56.53 -32.84 65.49 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 114.999 -1.0 . . . . 1.77 110.11 172.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.459 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 35.7 mmtm -75.62 151.67 37.77 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.367 -1.288 . . . . 1.63 111.471 -176.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.471 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 5.3 mtp -131.31 98.76 4.63 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.257 -0.883 . . . . 1.11 109.454 169.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.462 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.3 OUTLIER -158.02 158.06 34.13 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.485 -0.78 . . . . 0.22 111.38 -171.613 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.567 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -133.31 119.6 19.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.873 -1.058 . . . . 0.1 108.2 176.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.591 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.8 mtp180 -103.13 145.68 29.55 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.273 0.559 . . . . 2.99 111.476 -178.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.947 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -127.76 107.37 9.83 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.919 -1.037 . . . . 0.13 108.992 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.512 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.3 mp -88.49 103.8 14.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.745 0.307 . . . . 0.29 110.826 -171.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.446 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -67.01 144.08 44.34 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.107 -0.497 . . . . 0.54 112.164 178.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.544 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 84.6 mttt . . . . . 0 C--N 1.319 -0.739 0 N-CA-C 112.488 0.551 . . . . 0.55 112.488 -176.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.859 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 10.4 t70 . . . . . 0 N--CA 1.446 -0.666 0 N-CA-C 109.107 -0.701 . . . . 3.23 109.107 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -87.52 -2.62 58.74 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.021 0.378 . . . . 2.39 112.021 -175.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.2 p -68.76 -18.24 64.18 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.573 0.701 . . . . 2.96 109.612 175.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.859 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 2.7 ptpp? -84.16 35.3 0.53 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.196 -0.911 . . . . 2.49 110.943 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -45.16 115.07 0.83 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.413 0.625 . . . . 3.4 110.139 -176.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.55 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 78.1 ttt180 -90.48 159.25 16.62 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.884 -1.053 . . . . 3.8 108.664 -171.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mtpt -124.74 131.34 53.46 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 119.824 -0.75 . . . . 4.29 110.637 174.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.9 167.5 4.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.765 -1.107 . . . . 4.41 110.692 177.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -55.15 -32.86 62.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.756 0.312 . . . . 5.34 111.31 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.516 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 12.9 mm-40 -86.98 11.98 12.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.962 0.411 . . . . 5.38 111.537 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.17 32.0 65.95 Favored Glycine 0 N--CA 1.452 -0.287 0 CA-C-N 115.972 -0.558 . . . . 4.37 113.051 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.516 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 60.9 m-80 -89.52 130.61 35.82 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.23 -0.656 . . . . 4.51 109.23 174.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -64.51 104.2 0.76 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.569 -0.53 . . . . 4.28 109.569 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.55 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 7.4 m -120.63 97.91 5.56 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 122.022 0.915 . . . . 3.1 109.518 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.446 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 p -90.42 126.71 55.55 Favored Pre-proline 0 C--N 1.31 -1.13 0 CA-C-N 115.339 -0.846 . . . . 2.5 110.195 -175.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.45 ' HG2' ' CD ' ' A' ' 70' ' ' LYS . 78.4 Cg_exo . . . . . 0 C--N 1.348 0.51 0 C-N-CA 122.993 2.462 . . . . 1.87 112.449 -176.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.556 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 82.0 m-70 . . . . . 0 N--CA 1.447 -0.598 0 N-CA-C 107.088 -1.449 . . . . 0.72 107.088 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.591 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 19.9 ttm -140.99 124.21 16.52 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 118.904 0.775 . . . . 0.27 111.067 176.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.482 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.4 m-85 -113.94 128.17 56.28 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.227 -0.897 . . . . 0.27 109.641 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.468 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -80.4 152.27 28.94 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.925 -0.398 . . . . 1.26 109.925 177.732 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.453 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 19.9 m-85 -133.55 171.94 13.42 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.298 0.571 . . . . 0.32 111.835 -173.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -122.73 -8.03 8.48 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.035 -0.984 . . . . 2.38 110.894 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -146.01 128.31 15.81 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.213 0.53 . . . . 1.1 110.777 -176.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.443 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 8.6 mmm180 -63.24 -38.58 91.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.105 -0.952 . . . . 3.09 112.183 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.419 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 86.8 m -60.98 -36.3 79.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.816 0.341 . . . . 0.35 110.739 -178.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.617 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.0 t -67.41 -55.17 18.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.367 -0.379 . . . . 0.23 110.471 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.567 ' HA ' HD12 ' A' ' 60' ' ' LEU . 12.3 ptp -60.39 -36.54 78.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 0.17 111.128 -176.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 102' ' ' MET . 23.2 t70 -66.96 -42.96 84.29 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.544 -0.463 . . . . 0.34 110.132 177.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.454 ' O ' ' HB3' ' A' ' 102' ' ' MET . 1.5 t-20 -67.2 -44.95 78.33 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.437 0.46 . . . . 1.36 111.185 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.617 HG12 ' O ' ' A' ' 96' ' ' VAL . 33.6 mm -61.44 -56.36 18.32 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 109.412 -0.588 . . . . 0.12 109.412 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.871 ' HA ' HD12 ' A' ' 104' ' ' LEU . 18.9 ttpp -52.72 -44.57 66.44 Favored 'General case' 0 C--O 1.216 -0.678 0 O-C-N 123.529 0.518 . . . . 0.79 110.028 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.516 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 40.1 ttp -51.34 -54.17 28.93 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.075 -0.966 . . . . 0.28 111.24 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.754 ' O ' HG13 ' A' ' 107' ' ' ILE . 99.0 m -62.94 -51.31 67.41 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.419 -0.355 . . . . 0.18 110.877 178.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.947 HD13 HD21 ' A' ' 62' ' ' LEU . 29.5 mt -46.68 -53.52 11.51 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.728 0.775 . . . . 0.09 110.514 175.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.6 ' CG ' HD13 ' A' ' 48' ' ' LEU . 23.0 mt-30 -54.84 -41.96 71.36 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.366 -1.288 . . . . 1.2 112.345 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' A' ' 102' ' ' MET . 14.7 mm100 -64.19 -33.65 76.29 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.915 0.864 . . . . 2.37 109.841 178.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.754 HG13 ' O ' ' A' ' 103' ' ' THR . 14.9 mt -76.59 -46.16 31.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.25 -1.341 . . . . 0.15 111.426 -177.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.728 HD12 HD11 ' A' ' 48' ' ' LEU . 8.8 mt -62.31 -41.39 91.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.312 -0.404 . . . . 0.19 111.976 -176.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.427 ' HA ' ' HB2' ' A' ' 112' ' ' LYS . 33.1 t -57.79 -25.58 60.75 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.711 0.291 . . . . 1.14 111.028 -177.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 76.9 mtt180 -64.78 -39.8 94.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.368 0.604 . . . . 1.64 109.879 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.557 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 32.5 m-85 -93.84 -10.17 34.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.545 -0.752 . . . . 0.65 110.193 -179.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.427 ' HB2' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.605 0 N-CA-C 108.523 -0.917 . . . . 0.76 108.523 174.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.406 ' CD2' HG21 ' A' ' 103' ' ' THR . 68.6 m80 . . . . . 0 N--CA 1.469 0.496 0 N-CA-C 112.881 0.696 . . . . 0.75 112.881 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 p -146.53 167.24 24.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.647 0.737 . . . . 1.09 112.962 -172.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.49 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 176.01 -165.97 36.86 Favored Glycine 0 N--CA 1.445 -0.761 0 CA-C-N 114.511 -1.222 . . . . 0.16 110.049 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.81 135.69 38.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 118.017 0.908 . . . . 0.16 110.461 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.54 146.71 32.51 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.014 0.435 . . . . 0.11 111.111 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.569 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 52.2 mt -110.38 111.06 34.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.911 -0.586 . . . . 0.33 110.054 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -112.57 132.32 55.18 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 108.598 -0.89 . . . . 0.36 108.598 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 58.51 25.2 12.76 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 120.962 0.411 . . . . 0.8 110.539 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.7 mtpt 68.98 4.12 4.36 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.551 -0.75 . . . . 2.11 112.901 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.404 ' O ' ' HZ2' ' A' ' 29' ' ' TRP . 1.2 p -92.37 115.25 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 107.697 -1.224 . . . . 0.22 107.697 166.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.0 m -71.92 145.75 48.28 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.057 -0.52 . . . . 1.07 110.82 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.73 -158.76 10.57 Favored Glycine 0 N--CA 1.433 -1.538 0 C-N-CA 119.914 -1.136 . . . . 0.11 113.196 -177.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.7 mm -126.18 132.03 70.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 109.336 -0.616 . . . . 0.13 109.336 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.502 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -100.49 134.93 38.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.721 -0.474 . . . . 0.13 109.721 -177.559 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.11 128.18 27.7 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.416 -0.356 . . . . 0.1 111.054 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.2 mt -85.1 138.07 19.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.387 0.613 . . . . 0.27 109.932 175.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -106.93 99.4 8.97 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 114.808 -1.087 . . . . 1.24 110.299 -176.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -113.97 169.71 8.8 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.317 -0.623 . . . . 1.2 109.317 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.2 t70 76.16 -2.1 2.81 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 122.107 0.956 . . . . 0.58 109.857 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 23' ' ' SER . 34.6 m -103.2 -173.59 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.156 -1.384 . . . . 0.25 109.742 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.629 ' O ' HG23 ' A' ' 22' ' ' VAL . 28.4 m -72.68 167.31 34.57 Favored Pre-proline 0 C--N 1.318 -0.79 0 N-CA-C 105.065 -2.198 . . . . 1.13 105.065 173.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -42.09 127.71 3.99 Favored 'Trans proline' 0 C--N 1.355 0.896 0 CA-C-N 121.279 1.492 . . . . 0.16 112.412 -140.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -50.53 138.57 17.34 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 113.942 -1.481 . . . . 0.1 112.399 -166.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -123.39 168.77 12.1 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 114.259 -1.337 . . . . 0.32 111.817 -170.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.72 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.15 106.5 13.4 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.324 -1.361 . . . . 0.09 107.324 172.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.3 m -102.52 106.22 16.89 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 120.887 0.375 . . . . 0.17 110.785 -176.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.404 ' HZ2' ' O ' ' A' ' 12' ' ' VAL . 81.5 t90 -85.24 132.14 34.32 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.781 -0.822 . . . . 0.14 108.781 172.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.464 ' HG2' HG23 ' A' ' 37' ' ' VAL . 57.1 mtt180 -125.84 158.27 35.46 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.023 -0.732 . . . . 1.91 109.023 174.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.2 p -69.84 175.99 3.96 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 109.305 -0.628 . . . . 0.6 109.305 178.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 p -59.89 -38.3 81.85 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.231 -0.588 . . . . 0.26 111.034 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.0 -29.89 24.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.776 0.798 . . . . 2.12 109.36 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.426 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 94.66 16.41 42.56 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 114.737 -1.12 . . . . 0.23 112.331 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -69.11 -40.07 78.57 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.433 -0.58 . . . . 1.73 109.433 176.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -87.89 139.42 30.53 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.799 -0.815 . . . . 1.3 108.799 171.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.464 HG23 ' HG2' ' A' ' 30' ' ' ARG . 13.6 p -149.1 137.86 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.811 0.338 . . . . 0.17 110.828 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -144.5 123.16 12.54 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.756 -0.461 . . . . 0.41 109.756 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 49.2 m -112.81 131.94 55.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.732 0.641 . . . . 0.15 112.732 -174.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.72 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -99.31 131.03 47.38 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.597 0 N-CA-C 108.035 -1.098 . . . . 0.12 108.035 168.259 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.418 ' O ' HG12 ' A' ' 45' ' ' ILE . 63.9 t -93.86 121.38 44.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 O-C-N 121.122 -0.986 . . . . 0.11 108.843 171.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.61 -19.77 64.46 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.157 0.799 . . . . 0.08 113.157 -169.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.3 p -69.43 -14.44 62.89 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.05 -0.66 . . . . 0.87 109.681 175.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -109.62 10.54 24.96 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.599 -0.728 . . . . 0.15 110.076 -178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.533 HG21 ' CD1' ' A' ' 62' ' ' LEU . 24.6 mm -111.48 141.09 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 108.871 -0.788 . . . . 0.12 108.871 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -106.91 -43.67 4.6 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.908 0.385 . . . . 0.52 110.636 -177.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.455 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 1.0 OUTLIER -134.31 165.81 24.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.042 -0.526 . . . . 1.41 110.744 -174.822 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.78 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -150.32 132.35 15.26 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.706 -0.85 . . . . 0.73 108.706 177.816 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -134.91 123.11 22.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.969 -0.382 . . . . 1.94 109.969 -172.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -115.93 143.15 45.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.321 0.509 . . . . 0.22 110.907 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.622 HG21 ' HB3' ' A' ' 57' ' ' LYS . 62.0 p -61.73 120.78 59.72 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 115.884 -0.598 . . . . 0.26 110.859 -177.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.423 ' HD2' ' HB3' ' A' ' 55' ' ' SER . 24.6 Cg_exo -55.29 157.11 15.0 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.556 2.17 . . . . 0.38 111.445 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.23 -9.03 14.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.854 0.359 . . . . 0.66 111.854 -177.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.9 p -104.76 -9.46 18.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 1.5 111.829 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.596 ' OG ' ' HB ' ' A' ' 51' ' ' THR . 89.5 p -64.83 151.89 44.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.062 0.458 . . . . 0.85 111.092 -178.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.502 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 65.4 mt-10 -59.2 -22.7 61.43 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.823 0.82 . . . . 1.77 110.231 171.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.622 ' HB3' HG21 ' A' ' 51' ' ' THR . 9.9 mptt -101.43 169.42 8.88 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 114.27 -1.332 . . . . 1.63 112.838 -170.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.448 ' O ' ' HG3' ' A' ' 59' ' ' MET . 65.7 mmm -141.44 98.34 3.34 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.474 -1.239 . . . . 1.11 108.109 165.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.455 ' CE ' ' HG2' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -157.52 160.31 38.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.685 -0.689 . . . . 0.22 111.346 -169.733 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.536 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -131.99 120.38 22.37 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.046 -0.979 . . . . 0.1 108.481 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.525 ' HD3' ' CB ' ' A' ' 88' ' ' MET . 3.6 mmt85 -99.95 131.62 45.8 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 120.992 0.425 . . . . 2.99 110.37 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.943 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -112.84 106.44 14.76 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.563 -0.744 . . . . 0.13 109.0 175.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 4.7 mp -92.32 105.7 16.97 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 120.955 0.407 . . . . 0.29 111.163 -171.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -63.04 164.36 28.29 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.356 -0.838 . . . . 0.54 112.626 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.404 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.7 mttt . . . . . 0 C--N 1.316 -0.881 0 CA-C-O 121.567 0.699 . . . . 0.55 112.567 -176.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.803 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 22.1 t70 . . . . . 0 C--O 1.215 -0.719 0 N-CA-C 109.292 -0.632 . . . . 3.23 109.292 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.4 -2.65 6.58 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.109 0.411 . . . . 2.39 112.109 -172.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.9 p -80.18 -0.99 38.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.934 0.397 . . . . 2.96 110.716 171.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.803 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.4 ptpt -86.85 39.05 0.83 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.112 -0.495 . . . . 2.49 110.154 173.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.532 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 24.7 mmtm -43.71 113.81 0.56 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.982 -0.554 . . . . 3.4 110.366 -175.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.649 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 56.8 ttt180 -90.71 161.53 15.31 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.075 -1.083 . . . . 3.8 108.075 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 95.7 mttt -135.29 144.97 47.06 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 118.188 0.449 . . . . 4.29 110.053 175.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.453 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER -78.88 179.92 6.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.933 -0.576 . . . . 4.41 109.559 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -56.33 -29.76 61.73 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 111.913 0.338 . . . . 5.34 111.913 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.453 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 17.6 mt-10 -81.22 -40.83 23.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.855 0.359 . . . . 5.38 110.83 -178.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.22 15.47 2.05 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.427 -0.892 . . . . 4.37 112.835 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.538 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 41.0 m-80 -74.04 132.07 41.98 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.664 -0.495 . . . . 4.51 109.664 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -74.48 92.93 2.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.127 0.489 . . . . 4.28 110.028 -178.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.649 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 7.5 m -102.65 99.46 8.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.833 0.825 . . . . 3.1 109.227 -179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.532 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.85 125.57 62.25 Favored Pre-proline 0 C--N 1.312 -1.051 0 CA-C-N 115.886 -0.597 . . . . 2.5 110.492 -176.279 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo . . . . . 0 N--CA 1.459 -0.543 0 C-N-CA 122.852 2.368 . . . . 1.87 111.998 179.813 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.471 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 40.3 m-70 . . . . . 0 C--O 1.219 -0.517 0 N-CA-C 109.348 -0.612 . . . . 0.72 109.348 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.525 ' CB ' ' HD3' ' A' ' 61' ' ' ARG . 23.2 ttm -101.92 132.82 47.49 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.374 -0.53 . . . . 0.27 111.261 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -121.66 129.64 52.92 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.252 -0.648 . . . . 0.27 109.252 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.569 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -80.69 153.6 27.79 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 120.943 0.401 . . . . 1.26 110.186 176.687 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.499 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 21.2 m-85 -135.75 166.07 24.12 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.298 0.571 . . . . 0.32 111.195 -175.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -114.61 -19.32 11.16 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.198 -0.91 . . . . 2.38 109.869 176.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.549 ' HB2' HG23 ' A' ' 96' ' ' VAL . 18.7 m120 -134.89 123.66 23.79 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.884 -0.598 . . . . 1.1 110.788 -174.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.53 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 14.6 mmm180 -63.04 -34.25 77.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.337 -0.847 . . . . 3.09 112.236 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.4 m -62.16 -34.62 76.74 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.955 0.407 . . . . 0.35 110.777 -178.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.571 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.2 t -70.13 -58.01 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-N 116.03 -0.532 . . . . 0.23 110.265 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.536 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.3 ptp -55.32 -38.42 68.69 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.15 -0.477 . . . . 0.17 111.052 -177.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.429 ' N ' ' HG3' ' A' ' 97' ' ' MET . 30.1 t70 -63.9 -45.65 88.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.647 0.261 . . . . 0.34 110.448 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -71.69 -35.25 70.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.088 -0.505 . . . . 1.36 111.887 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.663 HG22 HD11 ' A' ' 104' ' ' LEU . 28.2 mm -66.95 -57.47 9.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 108.472 -0.936 . . . . 0.12 108.472 175.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.773 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.7 ttpt -48.0 -50.39 27.7 Favored 'General case' 0 C--O 1.219 -0.522 0 O-C-N 124.223 0.952 . . . . 0.79 109.899 176.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.693 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 48.1 ttp -48.19 -57.55 5.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.227 -0.897 . . . . 0.28 111.2 177.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.729 ' O ' HG13 ' A' ' 107' ' ' ILE . 45.1 m -58.45 -53.77 54.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.413 -0.358 . . . . 0.18 110.73 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.943 HD13 HD21 ' A' ' 62' ' ' LEU . 22.7 mt -47.21 -53.77 12.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.492 0.663 . . . . 0.09 110.561 176.054 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.661 ' CG ' HD13 ' A' ' 48' ' ' LEU . 22.8 mt-30 -53.66 -42.04 67.45 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.611 -1.177 . . . . 1.2 112.372 176.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.693 ' HG3' ' O ' ' A' ' 102' ' ' MET . 36.8 mt-30 -66.03 -31.65 72.67 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.782 0.801 . . . . 2.37 109.194 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.729 HG13 ' O ' ' A' ' 103' ' ' THR . 15.0 mt -77.35 -45.1 29.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 114.597 -1.183 . . . . 0.15 111.289 -177.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.78 HD12 HD11 ' A' ' 48' ' ' LEU . 9.8 mt -65.24 -38.45 82.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.166 -0.47 . . . . 0.19 112.177 -175.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.401 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 3.8 p -59.54 -26.49 65.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.878 0.37 . . . . 1.14 110.986 -179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -60.63 -50.58 72.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.79 0.805 . . . . 1.64 109.478 173.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 9.3 m-85 -89.96 28.31 1.4 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.71 -1.132 . . . . 0.65 110.1 177.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 112' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.714 0 N-CA-C 108.036 -1.098 . . . . 0.76 108.036 174.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.558 ' CD2' HG21 ' A' ' 103' ' ' THR . 73.7 m80 . . . . . 0 N--CA 1.473 0.681 0 N-CA-C 112.033 0.383 . . . . 0.75 112.033 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.9 p -157.25 155.7 31.24 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 119.943 -0.703 . . . . 1.09 112.318 -174.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.516 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -173.76 -162.17 25.14 Favored Glycine 0 N--CA 1.439 -1.124 0 CA-C-N 114.627 -1.169 . . . . 0.16 110.438 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -101.39 136.02 41.93 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 117.345 0.573 . . . . 0.16 110.162 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.5 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -147.45 141.15 25.63 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.988 0.423 . . . . 0.11 111.876 -176.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.479 HG12 ' HA ' ' A' ' 13' ' ' SER . 88.0 mt -105.58 122.26 58.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.147 -0.479 . . . . 0.33 109.937 175.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -127.79 131.2 49.62 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.723 -0.843 . . . . 0.36 108.723 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 60.28 29.62 19.16 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.909 0.484 . . . . 0.8 110.562 -177.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm 65.72 5.78 3.54 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.921 0.711 . . . . 2.11 112.921 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 p -98.49 119.91 47.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.476 -0.935 . . . . 0.22 108.476 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.479 ' HA ' HG12 ' A' ' 8' ' ' ILE . 52.5 p -74.34 144.71 44.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.158 -0.474 . . . . 1.07 110.904 -175.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.422 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.81 -159.57 10.26 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.258 -0.972 . . . . 0.11 113.286 -178.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 19.9 mm -125.93 134.73 65.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 109.107 -0.701 . . . . 0.13 109.107 -178.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.554 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.22 135.7 37.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 110.129 -0.323 . . . . 0.13 110.129 -176.572 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.59 129.03 30.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.985 0.421 . . . . 0.1 111.413 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.546 HD12 ' HA ' ' A' ' 3' ' ' HIS . 61.9 mt -85.91 135.37 25.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 109.763 -0.458 . . . . 0.27 109.763 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -108.67 103.28 12.35 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.096 -0.502 . . . . 1.24 111.182 -173.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 28.2 mt-10 -116.79 170.75 8.36 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.46 -0.941 . . . . 1.2 108.46 174.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.456 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.8 t70 81.07 -5.97 1.63 Allowed 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 122.428 1.109 . . . . 0.58 109.361 -176.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 23' ' ' SER . 32.7 m -103.33 -174.17 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 CA-C-N 113.753 -1.567 . . . . 0.25 109.943 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.662 ' O ' HG23 ' A' ' 22' ' ' VAL . 57.9 m -73.14 168.67 22.75 Favored Pre-proline 0 C--N 1.313 -1.001 0 N-CA-C 105.423 -2.066 . . . . 1.13 105.423 173.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -41.31 128.13 3.16 Favored 'Trans proline' 0 C--N 1.355 0.885 0 CA-C-N 121.296 1.499 . . . . 0.16 112.642 -143.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.488 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -51.44 141.7 15.14 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 113.993 -1.458 . . . . 0.1 112.563 -165.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.65 168.79 12.67 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 114.228 -1.351 . . . . 0.32 111.922 -170.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -116.53 107.3 14.57 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.398 -1.334 . . . . 0.09 107.398 172.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.6 m -104.49 106.7 17.3 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 120.878 0.371 . . . . 0.17 110.894 -175.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.7 t90 -85.12 132.34 34.32 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.842 -0.799 . . . . 0.14 108.842 172.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HG2' HG23 ' A' ' 37' ' ' VAL . 62.1 mtt180 -127.29 156.97 41.09 Favored 'General case' 0 C--N 1.31 -1.122 0 N-CA-C 108.893 -0.781 . . . . 1.91 108.893 174.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -68.76 176.04 3.25 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.385 -0.598 . . . . 0.6 109.385 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.422 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 9.3 p -60.13 -40.79 91.02 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.162 -0.615 . . . . 0.26 110.421 178.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -76.73 -31.33 57.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.85 0.833 . . . . 2.12 109.157 170.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.458 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 89.63 15.27 58.55 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 114.458 -1.247 . . . . 0.23 111.813 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -64.36 -53.37 49.7 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.288 -0.634 . . . . 1.73 109.288 174.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.0 tttt -76.76 139.28 40.36 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.328 -0.851 . . . . 1.3 108.878 174.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.5 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.4 p -149.43 138.81 15.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.927 0.394 . . . . 0.17 111.142 -178.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -144.18 126.21 15.45 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.751 -0.463 . . . . 0.41 109.751 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 30.0 m -114.7 133.22 56.05 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.396 0.517 . . . . 0.15 112.396 -173.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -101.74 130.05 52.0 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.592 0 N-CA-C 108.125 -1.065 . . . . 0.12 108.125 168.482 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.404 ' O ' HG12 ' A' ' 45' ' ' ILE . 63.3 t -93.72 121.93 44.77 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 O-C-N 121.194 -0.941 . . . . 0.11 108.801 173.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.594 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.35 -18.45 63.8 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.136 0.791 . . . . 0.08 113.136 -169.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.6 p -69.55 -15.47 63.23 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.922 -0.711 . . . . 0.87 109.562 174.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 p -109.84 12.2 24.03 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.464 -0.789 . . . . 0.15 110.013 -178.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.552 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.9 mm -111.54 138.91 38.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.991 -0.549 . . . . 0.12 109.659 178.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -100.1 -46.66 5.25 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.824 -0.625 . . . . 0.52 110.563 -177.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.493 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 18.1 mtmt -140.3 174.73 10.22 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.135 0.493 . . . . 1.41 111.442 -176.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.616 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -152.73 136.07 15.84 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.748 -0.834 . . . . 0.73 108.748 -179.35 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.557 ' HG2' HD11 ' A' ' 63' ' ' ILE . 6.8 mm100 -129.81 122.53 28.94 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 122.282 -0.261 . . . . 1.94 110.463 -175.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.455 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -116.09 140.97 48.74 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 122.052 -0.405 . . . . 0.22 111.279 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 66.6 p -66.97 119.3 63.03 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-N 116.099 -0.5 . . . . 0.26 110.146 -177.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.459 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 26.0 Cg_exo -54.25 159.91 7.28 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 122.721 2.28 . . . . 0.38 111.556 178.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.89 -15.69 63.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.195 -0.457 . . . . 0.66 110.573 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -86.14 -16.82 36.71 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 1.5 110.595 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.459 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 47.4 m -76.79 140.7 40.81 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.845 -0.616 . . . . 0.85 111.019 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -66.56 -18.68 65.5 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.404 -0.817 . . . . 1.77 110.7 176.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.575 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 11.2 mmmm -87.05 151.14 23.5 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.743 -1.117 . . . . 1.63 111.031 -175.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -124.93 96.57 4.92 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 108.121 -1.066 . . . . 1.11 108.121 169.139 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.575 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.23 155.96 34.77 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.458 0.647 . . . . 0.22 111.899 -174.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.606 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -134.36 119.25 18.4 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.698 -1.137 . . . . 0.1 108.329 175.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.727 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 3.5 mtp180 -102.42 142.78 33.08 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.249 0.547 . . . . 2.99 111.311 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.942 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -121.53 107.81 12.87 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.036 -0.984 . . . . 0.13 109.012 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.565 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.7 mp -90.81 103.67 14.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.773 -0.455 . . . . 0.29 109.773 -172.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.431 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -67.54 151.89 52.39 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 121.394 -0.432 . . . . 0.54 112.885 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.498 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 83.8 mttt . . . . . 0 C--N 1.322 -0.606 0 C-N-CA 122.655 0.382 . . . . 0.55 111.182 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.577 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.3 m-20 . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 107.993 -1.114 . . . . 3.23 107.993 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.68 -1.79 4.18 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.31 0.485 . . . . 2.39 112.31 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.2 p -69.21 -11.26 60.65 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.35 0.595 . . . . 2.96 109.861 168.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -84.69 26.41 0.82 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.399 -0.819 . . . . 2.49 111.382 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.7 mtmt -47.08 113.75 0.73 Allowed 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.432 0.634 . . . . 3.4 109.332 -174.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.47 ' HB3' HG23 ' A' ' 80' ' ' VAL . 72.6 ttt180 -96.85 168.61 10.39 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.692 -1.14 . . . . 3.8 109.069 -167.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 63.9 mttp -133.59 141.47 47.69 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 118.104 0.411 . . . . 4.29 110.185 174.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -82.11 -168.38 1.93 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.902 -0.59 . . . . 4.41 110.695 -177.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -56.84 -31.11 64.45 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.799 0.296 . . . . 5.34 111.799 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.448 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 10.6 mt-10 -86.86 -34.68 19.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.1 0.476 . . . . 5.38 110.444 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.94 18.36 5.15 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.478 -0.868 . . . . 4.37 112.049 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.551 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 30.8 m-80 -75.39 134.8 40.86 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.993 -0.744 . . . . 4.51 108.993 177.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -69.02 92.68 0.53 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.982 0.42 . . . . 4.28 110.235 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.47 HG23 ' HB3' ' A' ' 72' ' ' ARG . 19.0 m -97.22 99.58 9.16 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-O 121.677 0.751 . . . . 3.1 109.574 176.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 1.5 p -85.4 107.38 12.0 Favored Pre-proline 0 C--N 1.317 -0.844 0 N-CA-C 109.354 -0.61 . . . . 2.5 109.354 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo . . . . . 0 C--O 1.234 0.301 0 C-N-CA 123.48 2.786 . . . . 1.87 113.943 -170.868 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.557 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 77.8 m-70 . . . . . 0 C--O 1.217 -0.613 0 N-CA-C 107.541 -1.281 . . . . 0.72 107.541 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.727 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 22.9 ttm -140.97 132.35 26.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 119.135 0.88 . . . . 0.27 111.265 173.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.5 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.6 m-85 -122.18 128.74 51.58 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.339 -0.846 . . . . 0.27 109.588 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.477 ' O ' ' HA ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -81.65 150.57 28.01 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.943 -0.391 . . . . 1.26 109.943 177.251 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.427 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.1 m-85 -130.13 175.73 8.67 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.965 0.412 . . . . 0.32 111.55 -173.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -122.57 -9.53 8.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.715 -0.675 . . . . 2.38 110.494 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.51 ' HB2' HG23 ' A' ' 96' ' ' VAL . 52.6 m-80 -146.16 136.96 24.31 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.237 -0.438 . . . . 1.1 110.087 -179.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.464 ' HD3' ' HE1' ' A' ' 58' ' ' MET . 1.2 mpp_? -70.5 -35.09 73.03 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.905 -0.589 . . . . 3.09 111.544 -178.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.448 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 19.5 m -61.63 -36.34 80.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.801 0.334 . . . . 0.35 110.578 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.615 ' O ' HG12 ' A' ' 100' ' ' ILE . 17.5 t -64.71 -58.2 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 116.203 -0.453 . . . . 0.23 110.499 178.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.606 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.0 ptp -57.59 -39.1 76.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.17 110.916 -177.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.407 ' N ' ' HG3' ' A' ' 97' ' ' MET . 19.5 t70 -65.66 -42.14 91.7 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.641 -0.424 . . . . 0.34 110.208 177.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.448 ' HB2' ' O ' ' A' ' 95' ' ' THR . 1.6 t-20 -68.83 -43.97 74.42 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 123.27 0.356 . . . . 1.36 111.351 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 96' ' ' VAL . 31.4 mm -61.8 -56.58 16.81 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 N-CA-C 108.674 -0.862 . . . . 0.12 108.674 177.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.803 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.8 ttpt -50.81 -48.6 59.67 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.9 0.75 . . . . 0.79 109.864 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.685 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 44.2 ttp -49.35 -54.82 15.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.387 -0.824 . . . . 0.28 111.321 177.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.696 ' O ' HG13 ' A' ' 107' ' ' ILE . 30.0 m -61.92 -51.96 66.0 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.322 -0.399 . . . . 0.18 110.592 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.942 HD13 HD21 ' A' ' 62' ' ' LEU . 29.2 mt -46.48 -54.7 8.74 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.835 -0.62 . . . . 0.09 110.17 174.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.558 ' CG ' HD13 ' A' ' 48' ' ' LEU . 90.8 mt-30 -52.17 -43.87 64.34 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.747 -1.115 . . . . 1.2 112.262 176.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.685 ' HG3' ' O ' ' A' ' 102' ' ' MET . 38.0 mt-30 -64.3 -40.65 96.37 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.952 0.882 . . . . 2.37 108.966 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.696 HG13 ' O ' ' A' ' 103' ' ' THR . 7.8 mt -68.88 -42.22 82.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 114.29 -1.323 . . . . 0.15 111.163 -178.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.616 HD12 HD11 ' A' ' 48' ' ' LEU . 7.2 mt -66.91 -37.64 79.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.413 -0.358 . . . . 0.19 111.471 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.4 t -59.58 -28.85 67.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.699 0.285 . . . . 1.14 110.587 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -59.41 -53.6 56.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.281 -0.637 . . . . 1.64 109.281 173.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -86.99 32.97 0.66 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.2 -0.909 . . . . 0.65 110.265 176.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? . . . . . 0 C--N 1.317 -0.824 0 N-CA-C 107.384 -1.339 . . . . 0.76 107.384 174.394 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.561 ' HA ' HD12 ' A' ' 18' ' ' ILE . 74.5 m80 . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 112.015 0.376 . . . . 0.75 112.015 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.1 p -154.27 163.19 40.52 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 119.817 -0.753 . . . . 1.09 112.293 -176.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.529 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 177.0 -158.0 23.41 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 110.424 -1.07 . . . . 0.16 110.424 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.422 ' HA ' HD13 ' A' ' 15' ' ' ILE . . . -102.54 135.07 44.83 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 117.386 0.593 . . . . 0.16 110.472 179.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.522 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -147.26 142.74 27.53 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.274 -0.421 . . . . 0.11 111.247 -177.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.782 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 62.3 mt -101.72 126.46 55.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.993 -0.373 . . . . 0.33 109.993 175.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.442 ' O ' HG13 ' A' ' 12' ' ' VAL . 21.2 t80 -129.51 129.92 45.14 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.581 -0.896 . . . . 0.36 108.581 177.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 62.45 29.12 17.1 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 123.386 0.429 . . . . 0.8 110.5 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm 68.52 -0.12 2.38 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.982 0.734 . . . . 2.11 112.982 178.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.442 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.7 OUTLIER -92.86 116.86 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 108.228 -1.027 . . . . 0.22 108.228 166.915 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.5 p -73.24 142.27 47.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.29 -0.414 . . . . 1.07 110.42 -176.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.493 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -158.42 -158.17 8.87 Favored Glycine 0 N--CA 1.438 -1.21 0 C-N-CA 119.835 -1.174 . . . . 0.11 113.732 -176.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.422 HD13 ' HA ' ' A' ' 6' ' ' ALA . 18.8 mm -125.98 132.02 71.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.972 -0.614 . . . . 0.13 109.451 -177.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.543 HD11 HD11 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.25 136.38 34.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 110.014 -0.365 . . . . 0.13 110.014 -177.181 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.09 129.84 30.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.9 0.381 . . . . 0.1 111.318 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 3' ' ' HIS . 65.4 mt -86.25 132.64 31.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 110.011 -0.366 . . . . 0.27 110.011 177.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -105.29 101.88 11.4 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.128 -0.487 . . . . 1.24 110.608 -175.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -116.5 167.95 10.6 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.374 -0.602 . . . . 1.2 109.374 175.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 76.8 -2.56 2.66 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 122.165 0.984 . . . . 0.58 109.964 -175.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 23' ' ' SER . 30.4 m -102.64 -174.52 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.022 0 CA-C-N 114.051 -1.431 . . . . 0.25 109.324 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.614 ' O ' HG23 ' A' ' 22' ' ' VAL . 75.6 m -72.4 167.14 35.36 Favored Pre-proline 0 C--N 1.314 -0.942 0 N-CA-C 105.198 -2.149 . . . . 1.13 105.198 175.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.429 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 94.8 Cg_exo -41.9 127.75 3.78 Favored 'Trans proline' 0 C--N 1.354 0.85 0 CA-C-N 121.213 1.469 . . . . 0.16 112.136 -141.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.481 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.07 139.32 23.32 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 113.97 -1.468 . . . . 0.1 112.17 -163.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 24' ' ' PRO . 0.7 OUTLIER -125.48 168.44 13.63 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 114.225 -1.352 . . . . 0.32 111.823 -169.847 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.765 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -116.83 105.42 12.35 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 107.365 -1.346 . . . . 0.09 107.365 174.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.6 m -101.85 107.09 18.17 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 121.061 0.458 . . . . 0.17 111.122 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.9 t90 -85.21 132.04 34.34 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.044 -0.725 . . . . 0.14 109.044 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.723 ' HG2' HG23 ' A' ' 37' ' ' VAL . 66.2 mtp180 -123.06 163.22 20.92 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 109.039 -0.726 . . . . 1.91 109.039 172.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 p -71.26 177.52 3.83 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 108.95 -0.759 . . . . 0.6 108.95 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.493 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.0 OUTLIER -58.34 -36.68 73.81 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.316 -0.553 . . . . 0.26 111.017 179.684 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -88.98 -31.23 18.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.608 0.718 . . . . 2.12 109.91 171.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.62 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 96.76 16.25 36.96 Favored Glycine 0 N--CA 1.447 -0.613 0 CA-C-N 114.978 -1.01 . . . . 0.23 112.1 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -62.18 -43.47 98.75 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.084 -0.71 . . . . 1.73 109.084 172.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.1 tttt -89.9 141.73 28.37 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.76 -0.83 . . . . 1.3 108.76 174.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.723 HG23 ' HG2' ' A' ' 30' ' ' ARG . 7.9 p -149.4 136.46 13.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.942 0.401 . . . . 0.17 111.272 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -144.28 127.26 16.44 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.634 -0.506 . . . . 0.41 109.634 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 36.7 m -117.11 132.83 56.58 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.812 0.671 . . . . 0.15 112.812 -173.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.765 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -99.27 130.05 48.81 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.611 0 N-CA-C 108.017 -1.105 . . . . 0.12 108.017 168.693 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.421 ' O ' HG12 ' A' ' 45' ' ' ILE . 57.8 t -93.16 122.31 44.55 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 O-C-N 121.071 -1.018 . . . . 0.11 109.099 173.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.603 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.38 -19.38 63.83 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.736 0.643 . . . . 0.08 112.736 -170.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.422 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 13.7 p -69.8 -12.29 61.51 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.366 0.603 . . . . 0.87 109.635 174.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.4 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 4.7 p -112.62 13.8 20.02 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.328 -0.851 . . . . 0.15 109.879 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.554 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.5 mm -114.97 144.77 21.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.303 -0.629 . . . . 0.12 109.303 177.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -114.85 -37.39 4.2 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.691 0.281 . . . . 0.52 111.168 -177.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.45 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 9.8 mtmm -139.26 168.8 19.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.732 0.301 . . . . 1.41 111.43 -179.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.815 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -152.04 137.97 18.1 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 109.408 -0.59 . . . . 0.73 109.408 -179.521 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 8.4 mm100 -134.53 115.21 13.64 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 122.175 -0.328 . . . . 1.94 111.505 -171.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.567 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -114.44 144.41 43.35 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.765 -0.584 . . . . 0.22 112.195 -177.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 69.0 p -68.55 119.66 70.05 Favored Pre-proline 0 C--O 1.233 0.237 0 CA-C-N 115.418 -0.81 . . . . 0.26 110.784 -176.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.84 155.16 14.96 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.798 2.332 . . . . 0.38 111.723 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.6 -17.09 62.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.66 112.402 -174.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.5 t -99.81 -7.79 24.99 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.806 0.336 . . . . 1.5 110.766 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.2 m -71.87 138.5 48.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.218 0.532 . . . . 0.85 111.482 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -55.78 -23.66 31.16 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.038 -0.983 . . . . 1.77 111.084 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -88.67 148.55 23.96 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.874 -1.057 . . . . 1.63 111.875 -174.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.619 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -118.87 95.46 4.84 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.12 -1.067 . . . . 1.11 108.12 166.609 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.619 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -157.5 158.56 35.95 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.524 0.678 . . . . 0.22 112.505 -173.793 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -140.67 119.89 12.94 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.651 -1.158 . . . . 0.1 108.318 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.706 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.2 mtp180 -102.53 147.53 26.65 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.426 0.631 . . . . 2.99 112.014 -178.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.922 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -125.32 105.3 9.0 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.431 -1.259 . . . . 0.13 108.987 178.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.528 HD12 ' N ' ' A' ' 63' ' ' ILE . 3.1 mp -88.91 106.15 16.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 110.137 -0.32 . . . . 0.29 110.137 -174.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.459 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -66.52 166.2 39.05 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.936 -0.575 . . . . 0.54 112.925 -178.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.528 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 83.0 mttt . . . . . 0 C--N 1.317 -0.844 0 CA-C-O 120.861 0.363 . . . . 0.55 111.362 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.562 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 14.0 m-20 . . . . . 0 N--CA 1.449 -0.483 0 N-CA-C 108.995 -0.742 . . . . 3.23 108.995 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -69.25 -2.6 11.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.957 0.408 . . . . 2.39 111.42 -174.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.9 p -65.12 -17.33 64.38 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.524 -0.547 . . . . 2.96 109.524 169.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.562 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -79.42 132.53 36.41 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.187 0.994 . . . . 2.49 110.528 176.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.4 mmtm -101.4 116.85 33.73 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 114.646 -1.161 . . . . 3.4 109.246 167.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 41.0 ttm180 -99.33 157.57 16.31 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.463 -0.94 . . . . 3.8 108.463 176.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 50.9 mttp -128.25 147.19 50.58 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.811 -0.441 . . . . 4.29 109.811 174.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -90.29 -172.86 3.61 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.554 -0.748 . . . . 4.41 110.483 -175.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -58.55 -31.42 67.95 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.093 0.405 . . . . 5.34 112.093 -178.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.591 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 30.8 mt-10 -85.49 -22.69 28.1 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.907 -0.317 . . . . 5.38 110.96 -178.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 105.7 19.11 10.65 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.624 -0.798 . . . . 4.37 112.38 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.591 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 37.9 m-80 -77.88 140.61 39.34 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.383 -0.599 . . . . 4.51 109.383 177.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -74.23 95.67 2.66 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.469 -0.567 . . . . 4.28 109.469 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.3 m -107.88 98.79 7.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 109.003 -0.739 . . . . 3.1 109.003 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.426 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -89.0 114.55 60.62 Favored Pre-proline 0 C--N 1.316 -0.866 0 CA-C-N 115.892 -0.595 . . . . 2.5 110.375 -175.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 25.5 Cg_exo . . . . . 0 CA--C 1.51 -0.721 0 C-N-CA 123.036 2.491 . . . . 1.87 113.716 -174.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 79.5 m-70 . . . . . 0 C--O 1.218 -0.583 0 N-CA-C 107.505 -1.295 . . . . 0.72 107.505 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.706 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 19.5 ttm -140.74 130.55 24.39 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 118.914 0.779 . . . . 0.27 111.309 175.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.551 ' O ' ' HA ' ' A' ' 59' ' ' MET . 11.6 m-85 -116.61 138.05 51.72 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.371 -0.831 . . . . 0.27 109.614 178.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.782 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -81.06 159.04 24.87 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 109.078 -0.712 . . . . 1.26 109.078 174.381 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 18.1 m-85 -138.34 175.47 9.55 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.91 0.386 . . . . 0.32 111.478 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -130.63 -0.75 4.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.828 -0.624 . . . . 2.38 110.115 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.505 ' HB2' HG23 ' A' ' 96' ' ' VAL . 62.2 m-80 -147.1 133.55 19.69 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.176 -0.465 . . . . 1.1 110.223 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.429 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 36.0 mmt180 -72.01 -39.2 69.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.632 -0.713 . . . . 3.09 111.208 -178.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.4 m -60.84 -33.44 73.05 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.994 -0.548 . . . . 0.35 110.696 -177.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.638 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.3 t -67.25 -61.44 1.69 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 CA-C-N 116.052 -0.522 . . . . 0.23 110.247 176.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.581 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.3 ptp -54.69 -38.58 67.18 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.25 -0.432 . . . . 0.17 111.234 -175.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 102' ' ' MET . 29.9 t70 -62.98 -47.72 81.93 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.333 -0.394 . . . . 0.34 110.511 177.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -68.95 -39.01 79.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.992 -0.549 . . . . 1.36 111.619 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.668 HG22 HD11 ' A' ' 104' ' ' LEU . 35.7 mm -63.36 -58.92 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 109.039 -0.726 . . . . 0.12 109.039 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.811 ' HA ' HD12 ' A' ' 104' ' ' LEU . 14.6 ttpp -51.25 -47.76 62.34 Favored 'General case' 0 CA--C 1.508 -0.64 0 O-C-N 123.795 0.684 . . . . 0.79 109.818 177.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.69 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 37.8 ttp -51.19 -55.28 18.77 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.065 -0.971 . . . . 0.28 110.943 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.735 ' O ' HG13 ' A' ' 107' ' ' ILE . 31.9 m -60.41 -51.74 68.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.284 -0.416 . . . . 0.18 110.455 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.922 HD13 HD21 ' A' ' 62' ' ' LEU . 31.7 mt -47.38 -54.96 9.85 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.409 0.684 . . . . 0.09 110.312 175.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.666 ' CG ' HD13 ' A' ' 48' ' ' LEU . 23.5 mt-30 -53.7 -39.1 64.9 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.502 -1.226 . . . . 1.2 112.565 178.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.69 ' HG3' ' O ' ' A' ' 102' ' ' MET . 64.5 mt-30 -67.2 -42.46 84.09 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.863 0.839 . . . . 2.37 109.04 177.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.735 HG13 ' O ' ' A' ' 103' ' ' THR . 14.1 mt -64.8 -46.79 90.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.298 -1.319 . . . . 0.15 110.997 -179.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.815 HD12 HD11 ' A' ' 48' ' ' LEU . 7.6 mt -61.95 -32.22 53.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.841 -0.618 . . . . 0.19 111.222 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.408 ' HA ' ' HB2' ' A' ' 112' ' ' LYS . 38.5 t -61.44 -31.51 71.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.488 -0.324 . . . . 1.14 110.399 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -63.57 -40.19 96.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.375 0.607 . . . . 1.64 109.387 175.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.422 ' CG ' ' HA ' ' A' ' 43' ' ' SER . 35.0 m-85 -97.7 18.28 15.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.445 -0.798 . . . . 0.65 110.103 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.408 ' HB2' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.627 0 N-CA-C 107.717 -1.216 . . . . 0.76 107.717 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 73.1 m80 . . . . . 0 N--CA 1.477 0.923 0 N-CA-C 112.365 0.506 . . . . 0.75 112.365 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.2 p -156.91 166.2 34.02 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.519 0.563 . . . . 1.09 112.519 -171.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.482 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 174.45 -166.67 38.68 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.595 -1.002 . . . . 0.16 110.595 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.3 134.33 36.9 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 117.798 0.799 . . . . 0.16 110.301 178.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.424 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -147.36 144.74 28.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.171 0.51 . . . . 0.11 111.628 -178.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.498 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 98.2 mt -102.79 119.42 51.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.848 -0.615 . . . . 0.33 110.166 176.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.428 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.8 t80 -126.1 137.2 53.59 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 109.142 -0.688 . . . . 0.36 109.142 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 62.07 22.95 13.48 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.522 0.514 . . . . 0.8 109.761 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt 67.92 5.22 4.4 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.279 -0.873 . . . . 2.11 112.764 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.428 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.5 OUTLIER -95.48 126.88 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 108.671 -0.863 . . . . 0.22 108.671 166.447 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.456 ' HA ' HG12 ' A' ' 8' ' ' ILE . 27.3 p -77.35 142.8 39.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.226 0.536 . . . . 1.07 111.049 -175.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.92 -158.59 9.8 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 120.26 -0.971 . . . . 0.11 113.228 -177.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 35.1 mm -125.29 131.41 72.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 109.351 -0.611 . . . . 0.13 109.351 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.57 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -101.99 135.07 40.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 120.788 0.327 . . . . 0.13 110.144 -176.726 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.65 130.95 32.98 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.22 -0.446 . . . . 0.1 111.024 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.439 HD13 ' CG2' ' A' ' 103' ' ' THR . 34.3 mt -85.03 137.44 20.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.271 0.557 . . . . 0.27 110.171 177.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -109.31 105.05 14.3 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.144 -0.935 . . . . 1.24 111.232 -173.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.49 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -124.05 169.96 11.14 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.168 -0.469 . . . . 1.2 109.744 176.04 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.49 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.6 t70 80.96 -6.12 1.64 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 122.452 1.12 . . . . 0.58 109.293 -173.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 23' ' ' SER . 32.4 m -102.33 -172.48 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-N 113.699 -1.591 . . . . 0.25 109.128 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.602 ' O ' HG23 ' A' ' 22' ' ' VAL . 19.9 m -72.07 167.48 31.42 Favored Pre-proline 0 C--N 1.316 -0.878 0 N-CA-C 105.687 -1.968 . . . . 1.13 105.687 175.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 23' ' ' SER . 63.9 Cg_exo -41.7 127.39 3.47 Favored 'Trans proline' 0 C--N 1.352 0.719 0 CA-C-N 120.81 1.325 . . . . 0.16 112.728 -143.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.461 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -45.22 138.15 4.13 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 113.61 -1.632 . . . . 0.1 112.739 -166.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.55 169.34 12.0 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 113.908 -1.496 . . . . 0.32 111.615 -169.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.709 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.81 108.92 15.94 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 107.761 -1.2 . . . . 0.09 107.761 173.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.3 m -104.26 108.26 19.57 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.015 0.436 . . . . 0.17 111.176 -176.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.42 ' CD2' ' HB3' ' A' ' 9' ' ' PHE . 84.2 t90 -86.43 130.45 34.5 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.211 -0.662 . . . . 0.14 109.211 172.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.52 ' HG2' HG23 ' A' ' 37' ' ' VAL . 78.1 mtt180 -123.36 157.3 33.62 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 109.027 -0.731 . . . . 1.91 109.027 172.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.2 p -70.38 177.95 3.14 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.486 -0.561 . . . . 0.6 109.486 178.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.2 p -62.45 -38.29 89.21 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.905 -0.718 . . . . 0.26 110.405 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -78.8 -33.01 46.56 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.811 0.815 . . . . 2.12 108.969 171.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.457 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 91.89 10.53 61.3 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 114.459 -1.246 . . . . 0.23 112.637 177.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -65.44 -48.79 71.52 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.586 -0.524 . . . . 1.73 109.586 175.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.4 tttm -77.25 134.31 38.61 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.821 -0.807 . . . . 1.3 108.821 172.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.52 HG23 ' HG2' ' A' ' 30' ' ' ARG . 13.6 p -149.39 136.49 13.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 120.672 0.273 . . . . 0.17 110.701 -177.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -144.49 132.85 21.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.667 0.27 . . . . 0.41 110.316 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.434 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 37.0 m -116.52 133.43 56.02 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.501 0.556 . . . . 0.15 112.501 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.709 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.44 129.8 53.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.599 0 N-CA-C 108.383 -0.969 . . . . 0.12 108.383 169.247 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.6 t -92.53 119.63 40.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 O-C-N 121.207 -0.933 . . . . 0.11 108.805 173.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.53 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -66.94 -18.18 65.26 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.984 0.735 . . . . 0.08 112.984 -170.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.425 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 44.3 t -70.81 -14.94 62.6 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.204 -0.598 . . . . 0.87 109.624 175.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.447 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 3.5 p -109.34 9.97 25.61 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.517 -0.765 . . . . 0.15 110.002 -178.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.56 HG21 HD13 ' A' ' 62' ' ' LEU . 31.0 mm -110.36 137.91 40.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.831 -0.622 . . . . 0.12 109.327 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -103.29 -40.22 6.49 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.319 -0.4 . . . . 0.52 110.591 -175.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.591 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 25.2 mtpp -139.79 174.51 10.44 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.406 0.622 . . . . 1.41 111.962 -178.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.637 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -152.92 137.57 16.9 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.785 -1.098 . . . . 0.73 108.754 176.898 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -134.02 118.41 17.78 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 122.436 -0.165 . . . . 1.94 111.416 -173.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.454 ' HB2' ' HG ' ' A' ' 60' ' ' LEU . . . -117.42 144.09 45.34 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 122.062 -0.399 . . . . 0.22 111.693 -177.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.514 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 74.2 p -70.67 121.28 83.25 Favored Pre-proline 0 N--CA 1.463 0.202 0 CA-C-N 115.884 -0.598 . . . . 0.26 111.162 -175.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.56 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 22.6 Cg_exo -58.41 160.55 16.45 Favored 'Trans proline' 0 CA--C 1.528 0.204 0 C-N-CA 122.866 2.378 . . . . 0.38 111.939 175.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.16 -13.92 62.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 0.66 111.364 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.3 p -91.87 -15.49 28.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.263 0.554 . . . . 1.5 110.547 176.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.56 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 20.9 m -71.85 143.26 49.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.618 -0.719 . . . . 0.85 111.608 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -69.16 -8.32 44.44 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 114.951 -1.022 . . . . 1.77 110.653 176.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 30.5 mmtm -105.39 155.74 18.84 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 114.79 -1.095 . . . . 1.63 111.121 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.514 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 72.5 mmm -133.0 98.27 4.24 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.174 -0.676 . . . . 1.11 109.174 169.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.568 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.2 OUTLIER -157.88 160.59 37.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.01 -0.541 . . . . 0.22 111.562 -171.037 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -136.99 118.77 15.09 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.387 -0.968 . . . . 0.1 108.387 176.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.482 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 2.2 mtp180 -103.64 136.87 42.55 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.211 0.529 . . . . 2.99 111.439 -178.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.923 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -109.03 107.6 18.0 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.055 -0.975 . . . . 0.13 109.243 174.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.591 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.3 mp -85.56 101.7 10.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 110.137 -0.32 . . . . 0.29 110.137 -174.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -65.25 153.62 50.64 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 116.111 -0.495 . . . . 0.54 112.273 178.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.447 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 86.8 mttt . . . . . 0 C--N 1.319 -0.737 0 CA-C-O 121.129 0.49 . . . . 0.55 111.758 -176.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.832 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 15.2 t70 . . . . . 0 N--CA 1.45 -0.475 0 N-CA-C 107.965 -1.124 . . . . 3.23 107.965 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -75.76 -9.09 58.3 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.773 0.321 . . . . 2.39 110.963 -174.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.1 p -66.87 -9.52 38.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.061 0.458 . . . . 2.96 110.618 174.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.832 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 4.9 ptpp? -86.43 33.3 0.63 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.011 -0.541 . . . . 2.49 110.386 173.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -43.72 113.33 0.5 Allowed 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.474 0.654 . . . . 3.4 109.746 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.506 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 73.5 ttt180 -102.07 165.67 11.03 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 114.872 -1.058 . . . . 3.8 109.064 -167.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 85.8 mttt -134.67 150.43 50.63 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.607 -0.516 . . . . 4.29 109.607 171.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.495 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.8 OUTLIER -84.69 -170.85 3.32 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.606 -0.725 . . . . 4.41 110.416 -177.619 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -59.15 -32.13 69.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.772 0.32 . . . . 5.34 111.619 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.495 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 19.4 mt-10 -80.68 -45.13 17.67 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.931 0.396 . . . . 5.38 110.528 -179.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 130.77 17.08 1.55 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.69 -0.767 . . . . 4.37 112.466 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.561 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 36.6 m-80 -76.03 133.7 40.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.703 -0.48 . . . . 4.51 109.703 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.444 ' HA ' ' HG2' ' A' ' 73' ' ' LYS . 43.7 tt0 -71.16 93.76 1.09 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.255 0.55 . . . . 4.28 110.499 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 28.3 m -98.75 100.17 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-O 121.727 0.775 . . . . 3.1 109.455 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -86.88 107.48 14.37 Favored Pre-proline 0 C--N 1.316 -0.873 0 N-CA-C 108.715 -0.846 . . . . 2.5 108.715 176.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo . . . . . 0 C--O 1.235 0.35 0 C-N-CA 123.535 2.824 . . . . 1.87 113.579 -170.454 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.601 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 57.8 m-70 . . . . . 0 C--O 1.222 -0.381 0 N-CA-C 108.774 -0.824 . . . . 0.72 108.774 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.568 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 23.5 ttm -102.71 125.03 49.3 Favored 'General case' 0 CA--C 1.502 -0.87 0 C-N-CA 120.05 -0.66 . . . . 0.27 111.012 -175.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.424 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.0 m-85 -112.83 125.33 54.23 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.271 -0.877 . . . . 0.27 109.199 174.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.498 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -81.07 148.41 29.67 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.828 -0.434 . . . . 1.26 109.828 178.063 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.436 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 19.8 m-85 -130.01 168.57 16.5 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.283 0.563 . . . . 0.32 111.783 -172.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -120.51 -11.11 9.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.143 -0.935 . . . . 2.38 109.833 175.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.482 ' HB2' HG23 ' A' ' 96' ' ' VAL . 53.6 m-80 -136.85 128.67 29.06 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.373 0.606 . . . . 1.1 110.814 -178.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.488 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.2 mmm180 -68.03 -35.91 79.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.117 -0.947 . . . . 3.09 111.881 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.0 m -61.63 -37.97 85.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.783 0.325 . . . . 0.35 110.747 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.596 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.5 t -66.17 -58.41 6.78 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 CA-C-N 116.221 -0.445 . . . . 0.23 110.468 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.512 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.0 ptp -55.8 -39.49 71.37 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.333 -0.394 . . . . 0.17 111.286 -176.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.462 ' N ' ' HG3' ' A' ' 97' ' ' MET . 28.7 t70 -65.65 -39.25 91.19 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.87 -0.332 . . . . 0.34 110.332 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -74.44 -40.13 62.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.175 -0.466 . . . . 1.36 111.433 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.643 HG22 HD11 ' A' ' 104' ' ' LEU . 30.6 mm -61.72 -57.23 13.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 108.692 -0.855 . . . . 0.12 108.692 176.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.769 ' HA ' HD12 ' A' ' 104' ' ' LEU . 30.0 ttpt -50.66 -49.69 56.43 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 124.09 0.868 . . . . 0.79 109.848 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.476 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.0 ttp -49.98 -52.65 32.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.562 -0.745 . . . . 0.28 111.26 178.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.678 ' O ' HG13 ' A' ' 107' ' ' ILE . 23.3 m -59.68 -56.82 17.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.992 -0.549 . . . . 0.18 110.169 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.923 HD13 HD21 ' A' ' 62' ' ' LEU . 26.4 mt -45.6 -54.79 7.13 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.207 -0.906 . . . . 0.09 110.663 176.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.619 ' CG ' HD13 ' A' ' 48' ' ' LEU . 92.9 mt-30 -51.56 -46.33 63.36 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.704 -1.135 . . . . 1.2 112.488 177.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 102' ' ' MET . 17.5 mm100 -67.14 -34.77 78.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.46 0.648 . . . . 2.37 109.968 -179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.678 HG13 ' O ' ' A' ' 103' ' ' THR . 7.3 mt -71.35 -46.25 65.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 114.669 -1.15 . . . . 0.15 110.924 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.637 HD12 HD11 ' A' ' 48' ' ' LEU . 6.3 mt -59.24 -42.13 86.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.255 -0.43 . . . . 0.19 111.287 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.417 ' HA ' ' HB3' ' A' ' 112' ' ' LYS . 26.0 t -57.09 -28.33 62.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.5 -0.318 . . . . 1.14 111.12 -177.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -60.95 -39.0 87.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.408 0.623 . . . . 1.64 109.938 176.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.425 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 21.0 m-85 -94.47 -16.23 23.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.265 -0.88 . . . . 0.65 110.205 -178.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.417 ' HB3' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.568 0 CA-C-N 115.527 -0.761 . . . . 0.76 109.039 176.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.58 ' HA ' HD12 ' A' ' 18' ' ' ILE . 77.2 m80 . . . . . 0 C--O 1.22 -0.473 0 N-CA-C 112.304 0.483 . . . . 0.75 112.304 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.8 p -157.78 161.77 38.45 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 119.72 -0.792 . . . . 1.09 112.376 -175.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.491 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.02 -165.72 34.84 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 115.009 -0.996 . . . . 0.16 110.749 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.19 130.55 45.51 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.23 0.515 . . . . 0.16 110.44 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.4 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -144.63 143.58 30.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.043 0.449 . . . . 0.11 111.351 -177.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' A' ' 13' ' ' SER . 74.2 mt -99.23 128.27 51.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.647 -0.501 . . . . 0.33 109.647 174.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 12' ' ' VAL . 15.0 t80 -139.31 138.55 36.79 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.992 -0.744 . . . . 0.36 108.992 178.022 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 64.35 24.88 13.34 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.65 0.594 . . . . 0.8 109.494 -176.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp 65.72 1.02 1.64 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 114.992 -1.004 . . . . 2.11 113.027 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -94.53 130.06 43.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.863 -0.791 . . . . 0.22 108.863 168.688 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.434 ' HA ' HG12 ' A' ' 8' ' ' ILE . 20.4 m -78.68 144.08 35.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.824 0.345 . . . . 1.07 110.609 -175.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.401 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -162.34 -158.97 9.92 Favored Glycine 0 N--CA 1.439 -1.148 0 C-N-CA 119.92 -1.133 . . . . 0.11 113.743 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.4 mm -127.59 134.53 65.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.862 -0.792 . . . . 0.13 108.862 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.556 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.97 136.91 36.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.603 -0.271 . . . . 0.13 110.337 -176.034 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.68 130.03 31.52 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.911 0.386 . . . . 0.1 111.436 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.58 HD12 ' HA ' ' A' ' 3' ' ' HIS . 64.3 mt -86.2 135.45 25.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.308 -0.405 . . . . 0.27 110.022 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -106.75 103.36 12.78 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.005 -0.543 . . . . 1.24 110.902 -175.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 21.1 mt-10 -119.2 169.47 9.93 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.81 -0.811 . . . . 1.2 108.81 175.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 36.3 t70 78.97 -2.25 2.28 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.445 1.117 . . . . 0.58 109.443 -176.092 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 23' ' ' SER . 34.8 m -104.0 -173.01 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-N 113.675 -1.602 . . . . 0.25 110.314 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.627 ' O ' HG23 ' A' ' 22' ' ' VAL . 75.6 m -72.06 167.63 30.02 Favored Pre-proline 0 C--N 1.316 -0.889 0 N-CA-C 105.23 -2.137 . . . . 1.13 105.23 172.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -41.77 129.06 3.93 Favored 'Trans proline' 0 C--N 1.355 0.917 0 CA-C-N 121.345 1.516 . . . . 0.16 112.577 -144.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.479 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.77 142.64 18.31 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 114.124 -1.398 . . . . 0.1 112.336 -163.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.26 169.11 13.86 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 114.332 -1.304 . . . . 0.32 111.787 -169.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.718 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -120.75 105.5 10.8 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.803 -1.184 . . . . 0.09 107.803 174.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.9 m -102.48 107.5 18.49 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 121.072 0.463 . . . . 0.17 111.414 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.406 ' CD2' ' HB3' ' A' ' 9' ' ' PHE . 84.8 t90 -85.17 132.32 34.31 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.222 -0.659 . . . . 0.14 109.222 172.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HG2' HG23 ' A' ' 37' ' ' VAL . 63.7 mtt180 -125.75 159.37 32.53 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 108.92 -0.77 . . . . 1.91 108.92 173.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 p -69.25 176.44 3.3 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 109.31 -0.626 . . . . 0.6 109.31 178.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.401 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.8 p -57.87 -41.39 82.34 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.403 -0.519 . . . . 0.26 111.205 -178.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.86 -32.09 21.89 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.389 -0.597 . . . . 2.12 109.389 171.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.431 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 101.01 17.33 23.16 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.457 -0.792 . . . . 0.23 113.84 172.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.77 -44.36 77.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.253 0.526 . . . . 1.73 109.752 174.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.6 tttm -82.98 137.22 34.25 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.644 -0.872 . . . . 1.3 108.644 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.444 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.4 p -149.89 138.49 14.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.799 0.333 . . . . 0.17 111.432 -176.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -143.98 126.45 15.88 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.618 -0.512 . . . . 0.41 109.618 176.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 92.2 m -111.64 136.44 50.86 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.135 0.42 . . . . 0.15 112.135 -176.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.718 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.37 128.61 57.73 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.704 0 N-CA-C 108.154 -1.054 . . . . 0.12 108.154 169.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.438 ' O ' HG12 ' A' ' 45' ' ' ILE . 70.5 t -92.73 121.62 43.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 O-C-N 121.108 -0.995 . . . . 0.11 108.773 173.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.8 -17.08 63.39 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.923 0.712 . . . . 0.08 112.923 -169.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.9 p -72.04 -11.63 60.85 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.205 -0.598 . . . . 0.87 109.557 174.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 p -111.4 9.09 21.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.615 -0.721 . . . . 0.15 109.711 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.586 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.8 mm -113.33 141.49 28.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 108.963 -0.754 . . . . 0.12 108.963 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -107.08 -44.69 4.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.982 0.42 . . . . 0.52 110.489 -179.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.598 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 24.5 mtpp -133.0 172.16 13.0 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-O 121.711 0.767 . . . . 1.41 111.895 -175.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.622 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -153.28 138.93 17.84 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.332 -1.304 . . . . 0.73 108.284 178.414 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -137.23 118.56 14.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 117.736 0.244 . . . . 1.94 110.914 -173.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.47 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -115.04 141.6 47.77 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.715 0.293 . . . . 0.22 111.358 -177.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.47 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 73.3 p -65.68 120.29 67.31 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 115.764 -0.653 . . . . 0.26 111.01 -176.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.538 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 10.4 Cg_exo -60.42 161.51 20.19 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.395 2.063 . . . . 0.38 111.54 176.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.09 -21.48 65.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.66 110.92 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.4 p -78.81 -18.17 54.52 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.917 -0.583 . . . . 1.5 110.614 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.538 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 37.8 m -75.93 139.53 41.64 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.701 -0.681 . . . . 0.85 111.143 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.36 -11.92 46.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.129 -0.941 . . . . 1.77 110.712 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.445 ' HB3' HG21 ' A' ' 51' ' ' THR . 9.5 mptt -102.5 155.39 18.3 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 114.748 -1.115 . . . . 1.63 111.783 -174.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.47 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 71.9 mmm -130.77 99.38 4.92 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.359 -0.837 . . . . 1.11 109.296 170.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.464 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.6 OUTLIER -156.06 157.65 36.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.751 -0.659 . . . . 0.22 111.674 -173.224 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.7 tt -132.01 119.31 20.89 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 108.353 -0.98 . . . . 0.1 108.353 176.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.444 ' HA ' ' HA ' ' A' ' 88' ' ' MET . 54.9 mtm180 -101.62 140.58 35.72 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 120.849 0.357 . . . . 2.99 111.075 -178.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.933 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -116.72 105.25 12.2 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.429 -0.805 . . . . 0.13 109.403 175.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.598 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.5 mp -86.03 107.78 16.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 122.551 0.34 . . . . 0.29 110.317 -173.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -62.26 164.11 24.94 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.989 -0.624 . . . . 0.54 112.621 178.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 74.4 mttt . . . . . 0 C--N 1.318 -0.794 0 CA-C-O 121.237 0.541 . . . . 0.55 111.687 -179.831 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.666 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 36.6 m-20 . . . . . 0 CA--C 1.51 -0.593 0 N-CA-C 108.569 -0.9 . . . . 3.23 108.569 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -68.42 -1.29 6.17 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.128 0.418 . . . . 2.39 112.128 -171.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.0 p -67.33 -17.9 64.95 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.344 0.592 . . . . 2.96 109.789 169.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.666 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -78.65 32.65 0.2 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.41 -0.814 . . . . 2.49 111.183 178.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.417 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 12.0 mmmt -45.67 113.87 0.67 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.087 -0.708 . . . . 3.4 109.087 -175.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.547 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 36.0 ttm180 -105.55 165.49 11.11 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 115.78 -0.646 . . . . 3.8 109.289 -169.262 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 96.7 mttt -136.93 140.78 42.51 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.669 -0.493 . . . . 4.29 109.669 173.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -86.26 -165.04 1.14 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.221 -0.445 . . . . 4.41 110.587 -176.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -60.95 -30.83 70.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 5.34 111.317 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -82.95 -21.96 33.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.801 0.334 . . . . 5.38 110.739 -177.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.99 14.19 37.35 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.139 -0.784 . . . . 4.37 111.139 -175.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 80.0 m-20 -69.63 132.34 46.03 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 109.23 -0.655 . . . . 4.51 109.23 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -70.73 92.91 0.9 Allowed 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.348 -0.612 . . . . 4.28 109.348 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.547 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 17.4 m -101.22 98.62 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 CA-C-O 121.725 0.774 . . . . 3.1 109.418 177.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -85.65 102.69 2.76 Favored Pre-proline 0 C--N 1.314 -0.965 0 N-CA-C 108.366 -0.976 . . . . 2.5 108.366 175.229 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 46.5 Cg_exo . . . . . 0 CA--C 1.516 -0.39 0 C-N-CA 123.357 2.705 . . . . 1.87 113.478 -165.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 54.9 m-70 . . . . . 0 C--O 1.219 -0.54 0 N-CA-C 108.96 -0.755 . . . . 0.72 108.96 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.444 ' HA ' ' HA ' ' A' ' 61' ' ' ARG . 30.5 ttm -107.51 125.76 51.68 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 119.795 -0.762 . . . . 0.27 111.254 -176.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.4 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.8 m-85 -114.05 129.1 56.63 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.263 -0.88 . . . . 0.27 109.498 177.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.24 149.31 29.08 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.076 0.465 . . . . 1.26 110.275 178.041 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.424 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.7 m-85 -132.06 173.81 10.83 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.932 -0.576 . . . . 0.32 110.682 -175.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.595 ' C ' HD22 ' A' ' 93' ' ' ASN . 8.9 t-20 -123.11 -20.89 5.59 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.953 -0.567 . . . . 2.38 110.116 174.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.595 HD22 ' C ' ' A' ' 92' ' ' ASN . 0.9 OUTLIER -126.33 123.44 38.03 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.054 0.454 . . . . 1.1 110.786 -177.249 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.526 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 15.4 mmm180 -60.77 -33.31 72.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.504 -0.771 . . . . 3.09 112.654 179.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.8 m -64.38 -37.96 89.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.786 0.327 . . . . 0.35 110.819 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.626 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.4 t -66.23 -56.19 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 CA-C-N 116.299 -0.41 . . . . 0.23 110.489 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.588 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.8 ptp -57.24 -39.28 75.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.97 -0.559 . . . . 0.17 110.828 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.482 ' N ' ' HG3' ' A' ' 97' ' ' MET . 32.4 t70 -66.63 -41.06 88.91 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 120.722 -0.391 . . . . 0.34 110.451 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -69.22 -44.11 72.72 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.114 0.259 . . . . 1.36 111.08 179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.635 HG22 HD11 ' A' ' 104' ' ' LEU . 31.7 mm -61.09 -57.76 10.67 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 108.81 -0.811 . . . . 0.12 108.81 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.803 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.5 ttpt -50.83 -48.39 59.91 Favored 'General case' 0 C--O 1.215 -0.75 0 O-C-N 123.927 0.767 . . . . 0.79 109.863 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.704 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 41.5 ttp -49.09 -56.99 7.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.716 -0.674 . . . . 0.28 111.077 177.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.732 ' O ' HG13 ' A' ' 107' ' ' ILE . 26.0 m -58.72 -51.96 67.73 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.468 0.48 . . . . 0.18 110.473 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.933 HD13 HD21 ' A' ' 62' ' ' LEU . 29.1 mt -48.48 -54.03 15.76 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 123.451 0.701 . . . . 0.09 110.613 175.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.58 ' HG2' HD13 ' A' ' 48' ' ' LEU . 44.9 mt-30 -50.56 -44.99 56.83 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.701 -1.136 . . . . 1.2 111.825 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.704 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.9 mt-30 -63.29 -42.21 99.06 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 122.001 0.905 . . . . 2.37 108.986 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.732 HG13 ' O ' ' A' ' 103' ' ' THR . 10.2 mt -66.1 -45.98 89.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 114.1 -1.409 . . . . 0.15 111.311 -178.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.508 HD12 HD11 ' A' ' 48' ' ' LEU . 9.0 mt -64.21 -40.77 90.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.218 -0.446 . . . . 0.19 111.493 -178.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.4 t -58.54 -23.3 57.98 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.383 -0.371 . . . . 1.14 110.965 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -66.1 -52.14 51.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.427 0.632 . . . . 1.64 109.652 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -79.01 -11.67 60.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.475 -0.784 . . . . 0.65 110.441 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.447 -0.604 0 N-CA-C 108.747 -0.834 . . . . 0.76 108.747 173.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.517 ' HA ' HD12 ' A' ' 18' ' ' ILE . 76.4 m80 . . . . . 0 CA--C 1.512 -0.495 0 N-CA-C 110.734 -0.098 . . . . 0.75 110.734 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 t -152.53 149.08 28.12 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 118.885 -1.126 . . . . 1.09 113.928 -170.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.489 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -169.28 -172.13 35.65 Favored Glycine 0 N--CA 1.439 -1.111 0 CA-C-N 113.668 -1.605 . . . . 0.16 109.745 177.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.41 ' HB3' HD21 ' A' ' 92' ' ' ASN . . . -91.53 132.38 36.32 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 117.834 0.817 . . . . 0.16 110.323 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.466 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -144.12 146.6 32.89 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.196 -0.456 . . . . 0.11 111.435 -177.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.558 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 98.3 mt -107.47 123.75 62.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.281 -0.418 . . . . 0.33 110.706 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.424 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.0 t80 -127.19 137.54 52.95 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.305 -0.998 . . . . 0.36 108.305 177.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 58.35 26.24 13.8 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 122.775 0.43 . . . . 0.8 110.919 -178.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.4 mtmm 68.61 0.08 2.49 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.521 0.728 . . . . 2.11 112.915 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.424 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -92.4 116.82 34.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 108.53 -0.915 . . . . 0.22 108.53 169.014 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.446 ' HA ' HG12 ' A' ' 8' ' ' ILE . 50.2 p -70.92 145.18 50.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.114 0.483 . . . . 1.07 110.791 -176.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.0 -160.42 10.7 Favored Glycine 0 N--CA 1.436 -1.366 0 C-N-CA 120.297 -0.954 . . . . 0.11 113.087 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 23.0 mm -125.27 132.28 71.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.122 -0.695 . . . . 0.13 109.122 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.56 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -100.82 136.1 33.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 N-CA-C 109.856 -0.424 . . . . 0.13 109.856 -176.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.9 125.83 24.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.921 0.391 . . . . 0.1 111.523 -179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.551 HG12 HD23 ' A' ' 27' ' ' LEU . 74.5 mt -85.28 132.8 30.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.779 -0.452 . . . . 0.27 109.779 177.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -102.98 102.29 12.33 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.967 -0.56 . . . . 1.24 110.792 -174.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 13.5 mt-10 -116.02 170.16 8.7 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.256 -0.646 . . . . 1.2 109.256 176.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.447 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 35.5 t70 78.21 -4.59 2.18 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 122.394 1.092 . . . . 0.58 109.704 -176.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.672 HG23 ' O ' ' A' ' 23' ' ' SER . 32.5 m -103.15 -172.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-N 113.765 -1.561 . . . . 0.25 110.028 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.672 ' O ' HG23 ' A' ' 22' ' ' VAL . 58.2 m -72.89 169.65 16.65 Favored Pre-proline 0 C--N 1.315 -0.898 0 N-CA-C 105.686 -1.968 . . . . 1.13 105.686 173.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -41.96 129.21 4.19 Favored 'Trans proline' 0 C--N 1.359 1.126 0 CA-C-N 121.538 1.585 . . . . 0.16 112.328 -145.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.473 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -55.97 141.99 37.52 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 114.262 -1.335 . . . . 0.1 112.051 -161.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -123.47 168.94 11.9 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.568 -1.196 . . . . 0.32 111.915 -169.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.76 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -120.08 105.28 10.86 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 107.69 -1.226 . . . . 0.09 107.69 173.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.415 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.2 m -100.91 106.81 18.19 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 116.554 -0.294 . . . . 0.17 110.854 -176.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.41 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 83.8 t90 -85.07 130.41 34.62 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.98 -0.748 . . . . 0.14 108.98 171.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 58.0 mtt180 -126.46 155.2 42.62 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.067 -0.716 . . . . 1.91 109.067 174.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -69.0 176.19 3.29 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 109.634 -0.506 . . . . 0.6 109.634 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.7 p -61.24 -32.42 72.21 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.224 -0.59 . . . . 0.26 110.272 177.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -86.65 -31.64 20.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.674 0.749 . . . . 2.12 108.981 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.5 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 88.62 9.97 68.16 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.573 -1.194 . . . . 0.23 112.498 176.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -64.14 -48.42 76.13 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.795 -0.817 . . . . 1.73 108.795 173.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -77.35 136.1 38.42 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.284 -0.871 . . . . 1.3 109.134 173.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.456 HG23 ' HG2' ' A' ' 30' ' ' ARG . 11.6 p -150.15 139.24 15.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 120.739 0.304 . . . . 0.17 111.089 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -144.47 121.43 11.35 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.659 -0.497 . . . . 0.41 109.659 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 32.3 m -109.47 133.23 53.34 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.194 0.442 . . . . 0.15 112.194 -175.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.76 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.11 129.23 53.81 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.702 0 N-CA-C 108.253 -1.017 . . . . 0.12 108.253 169.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.4 t -92.92 121.77 43.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 O-C-N 121.036 -1.04 . . . . 0.11 108.769 173.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.558 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.67 -20.88 64.46 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.151 0.797 . . . . 0.08 113.151 -169.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.1 p -68.62 -14.56 63.09 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.159 -0.616 . . . . 0.87 109.735 174.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.3 p -111.1 14.86 21.84 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.568 -0.742 . . . . 0.15 109.703 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.541 HG21 HD13 ' A' ' 62' ' ' LEU . 24.1 mm -113.08 138.73 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 115.641 -0.709 . . . . 0.12 109.217 176.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -104.15 -40.53 6.12 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.204 -0.453 . . . . 0.52 110.51 -176.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.455 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 11.2 mtmm -141.62 170.64 15.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.325 -0.398 . . . . 1.41 110.93 -177.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.616 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -149.69 141.66 23.84 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.498 -0.927 . . . . 0.73 108.498 176.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.495 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 18.0 mm-40 -136.77 114.7 11.38 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 117.362 0.074 . . . . 1.94 111.069 -171.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.45 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -113.34 142.72 45.53 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.98 -0.45 . . . . 0.22 111.229 -179.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.483 HG21 ' HB3' ' A' ' 57' ' ' LYS . 34.8 p -62.01 122.32 71.44 Favored Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 115.822 -0.626 . . . . 0.26 110.985 -176.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.521 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 15.1 Cg_exo -59.21 159.6 21.97 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.554 2.169 . . . . 0.38 111.303 177.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.19 -14.81 63.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 0.66 110.857 -179.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 p -85.84 -17.19 36.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.631 -0.713 . . . . 1.5 110.845 176.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.521 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 45.2 m -78.73 135.67 37.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.717 -0.674 . . . . 0.85 111.133 -179.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -56.44 -34.44 66.84 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.333 -0.849 . . . . 1.77 110.061 172.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.483 ' HB3' HG21 ' A' ' 51' ' ' THR . 8.3 mptt -76.25 152.12 36.61 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 113.992 -1.458 . . . . 1.63 111.927 -174.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.441 ' HB3' ' HE3' ' A' ' 58' ' ' MET . 85.7 mmm -129.48 98.55 4.89 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.304 -0.862 . . . . 1.11 108.691 171.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.479 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.1 OUTLIER -154.07 153.84 32.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.882 -0.599 . . . . 0.22 111.53 -172.069 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.8 tt -130.33 118.91 21.99 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.342 -0.984 . . . . 0.1 108.342 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.655 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 1.6 mtp180 -103.41 149.21 25.02 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.458 0.647 . . . . 2.99 111.775 -178.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.934 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -127.65 104.98 8.16 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.38 -1.282 . . . . 0.13 108.901 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.538 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -88.3 105.0 15.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 110.196 -0.298 . . . . 0.29 110.196 -173.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.479 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -62.69 160.45 33.37 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 116.181 -0.463 . . . . 0.54 112.464 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.2 mttt . . . . . 0 C--N 1.316 -0.861 0 CA-C-O 121.654 0.74 . . . . 0.55 112.664 -177.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.78 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 20.9 t70 . . . . . 0 C--O 1.211 -0.955 0 N-CA-C 109.208 -0.664 . . . . 3.23 109.208 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.61 -4.52 4.23 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.865 0.691 . . . . 2.39 112.865 -170.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.57 -1.65 47.1 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.092 0.472 . . . . 2.96 110.673 172.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.78 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.2 ptmt -81.39 40.14 0.55 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.92 -0.582 . . . . 2.49 110.331 172.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.494 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 25.1 mmtm -43.53 114.32 0.62 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.705 -0.68 . . . . 3.4 110.665 -173.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 44.9 ttt180 -95.57 162.92 13.43 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 108.093 -1.077 . . . . 3.8 108.093 -175.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 20.0 mtpt -128.29 132.81 48.67 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.182 -0.673 . . . . 4.29 109.182 172.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -77.37 -171.92 2.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.63 -0.713 . . . . 4.41 110.696 -174.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -59.52 -32.05 69.94 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.775 0.287 . . . . 5.34 111.775 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.506 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 25.0 mt-10 -83.71 -19.06 35.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.031 0.443 . . . . 5.38 110.926 -179.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.434 ' O ' ' HE2' ' A' ' 73' ' ' LYS . . . 95.89 31.19 7.48 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.953 -0.567 . . . . 4.37 112.753 178.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.579 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 39.7 m-80 -92.35 148.17 22.34 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.046 -0.724 . . . . 4.51 109.046 175.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -72.55 89.38 1.28 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.11 0.481 . . . . 4.28 109.778 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.578 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 12.3 m -99.36 99.31 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.983 0 CA-C-O 121.884 0.849 . . . . 3.1 109.076 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.494 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.4 OUTLIER -85.22 119.38 72.33 Favored Pre-proline 0 C--N 1.31 -1.121 0 CA-C-N 115.601 -0.727 . . . . 2.5 109.994 -178.597 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 52.8 Cg_exo . . . . . 0 CA--C 1.513 -0.573 0 C-N-CA 122.638 2.225 . . . . 1.87 112.274 -178.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.561 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 80.3 m-70 . . . . . 0 C--O 1.216 -0.673 0 N-CA-C 107.415 -1.328 . . . . 0.72 107.415 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.655 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 8.1 ttm -141.1 125.49 17.6 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 119.049 0.84 . . . . 0.27 110.931 176.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.466 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.6 m-85 -116.84 127.95 54.79 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.356 -0.838 . . . . 0.27 109.654 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.558 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -80.93 150.72 28.88 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.717 0.294 . . . . 1.26 110.356 178.222 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.435 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 28.2 m-85 -133.46 175.47 9.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.515 0.674 . . . . 0.32 111.649 -174.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . 0.41 HD21 ' HB3' ' A' ' 6' ' ' ALA . 2.6 p30 -111.24 -29.44 7.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.952 -1.022 . . . . 2.38 110.998 178.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -138.13 142.89 40.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.003 0.43 . . . . 1.1 110.502 -177.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.61 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 11.0 mmm180 -64.99 -34.23 77.94 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.48 -0.782 . . . . 3.09 111.011 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 57.0 m -58.74 -39.28 80.45 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.115 -0.493 . . . . 0.35 110.626 -176.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.57 ' O ' HG12 ' A' ' 100' ' ' ILE . 9.7 t -67.15 -55.91 15.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.184 -0.462 . . . . 0.23 110.026 177.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.61 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 14.0 ptp -61.86 -41.34 97.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.17 111.237 -177.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.434 ' N ' ' HG3' ' A' ' 97' ' ' MET . 36.4 t70 -62.34 -37.1 84.36 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.394 -0.522 . . . . 0.34 110.504 178.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.417 ' HA ' ' HE2' ' A' ' 102' ' ' MET . 18.4 m-20 -74.08 -43.46 57.62 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.332 -0.395 . . . . 1.36 111.618 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.8 mm -63.71 -55.02 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 N-CA-C 108.962 -0.755 . . . . 0.12 108.962 176.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.875 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.8 ttpt -51.53 -45.48 62.98 Favored 'General case' 0 C--O 1.217 -0.609 0 O-C-N 123.574 0.546 . . . . 0.79 109.783 177.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.624 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 38.8 ttp -50.91 -59.8 3.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.839 -0.619 . . . . 0.28 111.308 177.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.794 ' O ' HG13 ' A' ' 107' ' ' ILE . 27.6 m -56.5 -49.77 73.75 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 123.471 0.482 . . . . 0.18 110.263 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.934 HD13 HD21 ' A' ' 62' ' ' LEU . 30.9 mt -48.48 -55.32 11.28 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 123.026 0.53 . . . . 0.09 110.579 174.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.547 ' HG2' HD13 ' A' ' 48' ' ' LEU . 45.0 mt-30 -54.22 -42.41 69.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.141 -0.936 . . . . 1.2 111.712 176.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.624 ' HG3' ' O ' ' A' ' 102' ' ' MET . 21.4 mt-30 -64.71 -28.64 69.73 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.769 0.795 . . . . 2.37 109.457 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.794 HG13 ' O ' ' A' ' 103' ' ' THR . 10.7 mt -84.52 -45.34 17.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.672 -1.149 . . . . 0.15 111.232 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.541 HD12 HD11 ' A' ' 48' ' ' LEU . 9.8 mt -63.24 -38.81 83.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.28 -0.418 . . . . 0.19 111.582 -177.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.424 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 4.7 p -57.75 -26.87 62.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.41 -0.359 . . . . 1.14 111.351 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -62.6 -47.18 84.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.413 0.625 . . . . 1.64 109.557 174.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -89.67 8.18 32.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.548 -0.751 . . . . 0.65 110.186 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.424 ' CB ' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.516 0 N-CA-C 108.631 -0.877 . . . . 0.76 108.631 176.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.623 ' HA ' HD12 ' A' ' 18' ' ' ILE . 77.8 m80 . . . . . 0 N--CA 1.472 0.663 0 N-CA-C 112.835 0.68 . . . . 0.75 112.835 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.3 t -156.74 159.17 38.07 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 119.773 -0.771 . . . . 1.09 112.131 -174.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.526 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.18 -168.82 39.78 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 114.478 -1.237 . . . . 0.16 110.099 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.7 131.93 39.99 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 117.49 0.645 . . . . 0.16 110.398 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.434 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -142.36 144.82 33.35 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.133 0.492 . . . . 0.11 111.561 -177.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.6 mt -111.52 119.45 59.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.883 -0.599 . . . . 0.33 110.258 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -120.65 137.37 54.49 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.717 -0.846 . . . . 0.36 108.717 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 54.74 26.57 7.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 122.737 0.415 . . . . 0.8 111.019 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp 68.37 5.34 4.7 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.825 0.676 . . . . 2.11 112.825 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.5 p -94.9 116.54 36.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 108.216 -1.031 . . . . 0.22 108.216 166.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.9 m -73.0 144.71 47.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.023 0.439 . . . . 1.07 111.077 -175.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.0 -158.43 9.32 Favored Glycine 0 N--CA 1.437 -1.257 0 C-N-CA 120.686 -0.769 . . . . 0.11 112.803 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -125.95 134.62 66.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.184 -0.673 . . . . 0.13 109.184 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.586 HD11 HD11 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.14 135.34 39.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.983 -0.377 . . . . 0.13 109.983 -177.053 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.75 127.86 27.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.948 0.404 . . . . 0.1 111.518 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.623 HD12 ' HA ' ' A' ' 3' ' ' HIS . 65.6 mt -86.02 133.75 28.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.169 -0.469 . . . . 0.27 109.94 177.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -106.31 102.01 11.45 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.822 -0.626 . . . . 1.24 110.784 -174.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -116.28 169.35 9.36 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.189 -0.671 . . . . 1.2 109.189 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t70 76.7 -2.23 2.73 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 122.413 1.101 . . . . 0.58 109.737 -176.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 23' ' ' SER . 33.3 m -103.47 -173.71 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 113.743 -1.572 . . . . 0.25 109.959 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.644 ' O ' HG23 ' A' ' 22' ' ' VAL . 59.5 m -72.96 168.56 23.48 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 105.306 -2.109 . . . . 1.13 105.306 173.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.707 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 72.9 Cg_exo -40.7 128.32 2.58 Favored 'Trans proline' 0 C--N 1.356 0.941 0 CA-C-N 121.55 1.589 . . . . 0.16 112.821 -143.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.86 140.08 25.36 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 114.357 -1.292 . . . . 0.1 112.039 -164.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -126.47 168.92 13.56 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.597 -1.183 . . . . 0.32 112.076 -168.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.76 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -120.25 104.24 9.9 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 107.375 -1.343 . . . . 0.09 107.375 174.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.7 m -101.69 107.87 19.23 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.07 0.462 . . . . 0.17 111.116 -176.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -85.1 131.78 34.4 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.973 -0.751 . . . . 0.14 108.973 172.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.487 ' HG2' HG23 ' A' ' 37' ' ' VAL . 96.3 mtt180 -126.2 158.15 36.38 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.156 -0.683 . . . . 1.91 109.156 173.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -69.73 174.55 5.02 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.226 -0.657 . . . . 0.6 109.226 178.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.6 p -60.96 -35.52 76.97 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 119.93 -0.708 . . . . 0.26 110.504 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -85.58 -29.34 24.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.613 0.721 . . . . 2.12 109.5 173.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.458 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 90.78 16.76 54.08 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 114.843 -1.072 . . . . 0.23 112.68 175.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -69.1 -51.41 38.82 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.954 -0.758 . . . . 1.73 108.954 173.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.8 tttt -75.72 136.01 40.35 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.9 -0.778 . . . . 1.3 108.9 173.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.487 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.0 p -149.75 134.82 10.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 120.826 0.346 . . . . 0.17 111.047 -177.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -143.87 121.09 11.53 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.977 -0.379 . . . . 0.41 109.977 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.411 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 60.9 m -111.04 137.05 49.15 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.365 0.505 . . . . 0.15 112.365 -174.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.76 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.85 130.18 56.27 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.668 0 N-CA-C 108.392 -0.966 . . . . 0.12 108.392 170.559 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.0 t -92.55 119.7 40.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 O-C-N 121.005 -1.059 . . . . 0.11 108.854 173.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.62 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -67.05 -22.82 65.85 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.662 0.615 . . . . 0.08 112.662 -170.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.707 ' OG ' ' HB3' ' A' ' 24' ' ' PRO . 9.7 m -63.87 -18.39 64.12 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.57 0.7 . . . . 0.87 109.482 175.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.1 p -113.72 17.83 17.87 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.164 -0.925 . . . . 0.15 110.034 -177.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.551 HD13 ' HA2' ' A' ' 64' ' ' GLY . 23.9 mm -113.95 140.82 32.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.896 -0.779 . . . . 0.12 108.896 176.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -102.4 -43.48 5.66 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.897 0.379 . . . . 0.52 110.555 -176.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.476 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 17.2 mtmm -141.81 173.04 11.88 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.086 -0.507 . . . . 1.41 110.988 -177.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.637 HD11 HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -151.57 148.63 28.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.621 -0.718 . . . . 0.73 109.148 179.833 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.683 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -133.6 153.22 51.83 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 110.391 -0.226 . . . . 1.94 110.391 -174.872 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.438 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -150.46 140.18 21.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.642 0.258 . . . . 0.22 110.785 176.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.457 HG21 ' HB3' ' A' ' 57' ' ' LYS . 40.9 p -66.3 118.06 49.52 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.614 -0.721 . . . . 0.26 110.653 -177.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.412 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 12.7 Cg_exo -57.0 159.31 15.03 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.761 2.307 . . . . 0.38 111.897 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.44 -15.92 63.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.195 -0.457 . . . . 0.66 111.316 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.7 m -83.53 -18.57 37.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.232 0.539 . . . . 1.5 110.998 175.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.412 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 73.2 m -79.29 138.31 37.7 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.492 -0.776 . . . . 0.85 111.585 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -62.3 -30.89 71.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.244 -0.889 . . . . 1.77 110.317 174.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.457 ' HB3' HG21 ' A' ' 51' ' ' THR . 1.9 mptp? -77.35 153.01 34.18 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 114.183 -1.371 . . . . 1.63 111.64 -175.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.424 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 1.0 OUTLIER -129.3 98.5 4.9 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.886 -1.052 . . . . 1.11 108.639 172.052 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.472 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.1 OUTLIER -154.64 159.7 40.97 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.351 0.595 . . . . 0.22 111.878 -173.687 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -140.96 119.31 12.17 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.69 -1.141 . . . . 0.1 108.416 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.683 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 25.5 mtp180 -103.7 136.68 42.95 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 121.285 0.565 . . . . 2.99 110.863 -179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.914 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -111.51 104.39 12.8 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.601 -0.727 . . . . 0.13 109.197 176.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.526 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.7 mp -86.53 101.85 11.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.946 -0.39 . . . . 0.29 109.946 -174.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.551 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -61.49 163.97 21.45 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.783 -0.644 . . . . 0.54 112.784 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.526 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 82.0 mttt . . . . . 0 N--CA 1.442 -0.848 0 CA-C-O 121.954 0.883 . . . . 0.55 112.816 -177.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.652 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 1.9 t70 . . . . . 0 CA--C 1.512 -0.509 0 N-CA-C 108.577 -0.897 . . . . 3.23 108.577 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.6 -7.61 3.51 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.881 0.697 . . . . 2.39 112.881 -168.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.6 p -64.49 -19.47 65.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.306 0.574 . . . . 2.96 109.567 172.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.652 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.1 ptmt -76.41 40.49 0.22 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.382 -0.826 . . . . 2.49 110.978 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.506 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 19.4 mmtm -44.21 113.48 0.54 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.508 -0.553 . . . . 3.4 109.508 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.625 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 50.4 ttt180 -94.97 156.23 16.41 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.733 -0.84 . . . . 3.8 108.733 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -130.36 134.62 47.3 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 121.333 0.587 . . . . 4.29 110.753 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -74.98 174.0 9.92 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.79 -1.096 . . . . 4.41 110.157 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -51.94 -32.05 31.44 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.774 0.657 . . . . 5.34 112.774 -174.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -87.66 7.56 29.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.696 0.284 . . . . 5.38 111.428 -177.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.11 10.96 85.62 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.944 -0.646 . . . . 4.37 112.011 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -72.08 131.62 43.09 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.342 -0.614 . . . . 4.51 109.342 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -70.01 113.18 6.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.988 0.423 . . . . 4.28 110.171 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.625 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 3.7 m -126.88 98.68 4.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 108.62 -0.882 . . . . 3.1 108.62 176.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.506 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.6 p -97.17 124.67 48.57 Favored Pre-proline 0 C--N 1.311 -1.08 0 CA-C-N 115.63 -0.714 . . . . 2.5 111.045 -171.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo . . . . . 0 CA--C 1.513 -0.536 0 C-N-CA 123.0 2.467 . . . . 1.87 112.707 -177.962 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.577 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 58.3 m-70 . . . . . 0 C--O 1.216 -0.661 0 N-CA-C 109.677 -0.49 . . . . 0.72 109.677 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.578 ' CB ' ' HG2' ' A' ' 61' ' ' ARG . 14.5 ttm -106.43 120.69 42.55 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 119.768 -0.773 . . . . 0.27 110.738 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.434 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.9 m-85 -111.46 130.62 55.66 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.075 -0.966 . . . . 0.27 109.524 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.472 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.15 153.82 27.06 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.358 -0.608 . . . . 1.26 109.358 174.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.418 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 17.3 m-85 -131.27 172.93 11.58 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.436 0.636 . . . . 0.32 111.915 -174.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -109.44 -22.48 11.99 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.623 -1.171 . . . . 2.38 110.833 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.452 ' HB2' HG23 ' A' ' 96' ' ' VAL . 48.5 m-80 -144.55 134.88 24.36 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.55 0.691 . . . . 1.1 111.457 -176.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.438 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.2 mmm180 -59.32 -40.32 85.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.533 -1.212 . . . . 3.09 112.593 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.464 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 28.8 m -62.21 -34.97 77.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.79 0.329 . . . . 0.35 110.758 -178.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 100' ' ' ILE . 17.3 t -66.17 -57.1 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.415 0 CA-C-N 116.308 -0.406 . . . . 0.23 110.476 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.525 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.4 ptp -58.22 -40.23 81.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.034 -0.53 . . . . 0.17 111.016 -177.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 102' ' ' MET . 26.1 t70 -65.7 -41.38 92.43 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.418 -0.513 . . . . 0.34 110.086 178.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 95' ' ' THR . 1.7 t-20 -68.3 -44.3 75.75 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.178 0.299 . . . . 1.36 111.336 -179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.663 HG22 HD11 ' A' ' 104' ' ' LEU . 30.6 mm -61.51 -56.95 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 N-CA-C 108.684 -0.858 . . . . 0.12 108.684 178.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.788 ' HA ' HD12 ' A' ' 104' ' ' LEU . 30.6 ttpt -50.08 -49.94 49.73 Favored 'General case' 0 C--O 1.217 -0.632 0 O-C-N 124.052 0.845 . . . . 0.79 109.821 176.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.576 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 49.9 ttp -49.26 -53.33 22.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.406 -0.815 . . . . 0.28 111.289 178.014 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.689 ' O ' HG13 ' A' ' 107' ' ' ILE . 20.7 m -61.03 -54.93 38.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.178 -0.464 . . . . 0.18 110.378 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.914 HD13 HD21 ' A' ' 62' ' ' LEU . 23.6 mt -46.72 -53.73 11.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.275 -0.875 . . . . 0.09 110.646 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.582 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.9 mt-30 -51.97 -43.08 63.4 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.715 -1.129 . . . . 1.2 112.397 177.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 102' ' ' MET . 24.7 mm-40 -70.63 -30.11 66.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.736 0.779 . . . . 2.37 109.897 -178.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.689 HG13 ' O ' ' A' ' 103' ' ' THR . 13.1 mt -75.98 -47.3 32.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 114.582 -1.19 . . . . 0.15 111.028 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.637 HD12 HD11 ' A' ' 48' ' ' LEU . 8.5 mt -58.46 -43.09 86.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.968 -0.56 . . . . 0.19 112.444 -176.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.625 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 16.5 t -67.53 -17.98 64.86 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.933 0.346 . . . . 1.14 111.933 -174.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -61.22 -31.95 71.73 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.499 -0.926 . . . . 1.64 108.499 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.458 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 15.4 m-85 -105.59 12.99 30.6 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.607 -1.179 . . . . 0.65 109.884 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.625 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 5.2 mmpt? . . . . . 0 C--N 1.324 -0.52 0 N-CA-C 108.631 -0.878 . . . . 0.76 108.631 171.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.509 ' CD2' HG21 ' A' ' 103' ' ' THR . 27.2 m80 . . . . . 0 CA--C 1.516 -0.332 0 N-CA-C 110.261 -0.274 . . . . 0.75 110.261 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.1 t -156.03 155.76 33.22 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 119.981 -0.687 . . . . 1.09 112.411 -172.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.48 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -176.07 -163.84 29.32 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 110.523 -1.031 . . . . 0.16 110.523 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.9 130.08 46.05 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 117.308 0.554 . . . . 0.16 110.533 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.488 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -140.26 143.33 35.89 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.955 0.407 . . . . 0.11 111.548 -178.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.547 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 97.3 mt -106.89 109.24 27.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.076 -0.511 . . . . 0.33 110.124 176.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -110.19 137.97 47.2 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.533 -0.914 . . . . 0.36 108.533 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 53.59 25.84 5.21 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 122.705 0.402 . . . . 0.8 111.154 -176.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt 69.52 5.08 4.98 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.521 0.563 . . . . 2.11 112.521 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.432 HG13 ' CH2' ' A' ' 29' ' ' TRP . 2.2 p -94.28 120.53 43.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 107.809 -1.182 . . . . 0.22 107.809 167.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.478 ' HA ' HG12 ' A' ' 8' ' ' ILE . 78.3 p -73.04 142.83 47.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.291 -0.413 . . . . 1.07 110.762 -175.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -163.07 -163.77 16.53 Favored Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.506 -0.854 . . . . 0.11 112.672 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.9 mm -123.41 133.85 67.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 109.293 -0.632 . . . . 0.13 109.293 -179.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.596 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.84 135.2 41.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 110.103 -0.332 . . . . 0.13 110.103 -176.257 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.45 129.99 29.81 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.693 0.282 . . . . 0.1 111.254 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.445 HD13 ' HB ' ' A' ' 103' ' ' THR . 47.6 mt -85.89 132.86 30.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.478 0.656 . . . . 0.27 110.439 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -102.82 104.92 15.23 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.748 -1.115 . . . . 1.24 111.064 -173.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -118.42 170.2 9.12 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.146 -0.687 . . . . 1.2 109.146 176.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.0 t70 79.26 -3.8 2.11 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 122.326 1.06 . . . . 0.58 109.557 -176.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 23' ' ' SER . 30.2 m -102.99 -173.1 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-N 113.832 -1.531 . . . . 0.25 109.427 178.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.634 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.1 p -73.56 169.39 18.59 Favored Pre-proline 0 C--N 1.316 -0.858 0 N-CA-C 105.585 -2.006 . . . . 1.13 105.585 175.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.422 ' O ' HG13 ' A' ' 41' ' ' VAL . 74.5 Cg_exo -40.83 129.42 2.78 Favored 'Trans proline' 0 C--N 1.358 1.073 0 CA-C-N 121.486 1.566 . . . . 0.16 112.628 -143.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.55 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -54.22 144.03 21.26 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 114.166 -1.379 . . . . 0.1 112.158 -162.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -125.25 168.83 12.94 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.497 -1.229 . . . . 0.32 111.864 -169.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.819 ' HB3' HG22 ' A' ' 40' ' ' VAL . 2.8 tm? -118.32 106.45 12.78 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 107.592 -1.262 . . . . 0.09 107.592 173.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.1 m -103.31 106.95 17.58 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 120.904 0.383 . . . . 0.17 111.027 -175.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.437 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 85.0 t90 -85.16 131.76 34.39 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.859 -0.793 . . . . 0.14 108.859 172.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 65.1 mtt180 -126.24 159.59 32.61 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.287 -0.634 . . . . 1.91 109.287 174.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.8 p -67.51 176.09 2.53 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.013 -0.736 . . . . 0.6 109.013 177.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.9 p -59.59 -41.75 90.98 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.659 -0.65 . . . . 0.26 111.013 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -82.82 -31.67 28.01 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.272 -0.64 . . . . 2.12 109.272 171.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.445 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 101.48 17.22 22.45 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.161 -0.927 . . . . 0.23 113.595 172.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -65.8 -52.04 54.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.203 0.501 . . . . 1.73 109.928 174.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.8 tttt -77.01 135.93 38.69 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 109.058 -0.719 . . . . 1.3 109.058 176.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 13.8 p -150.03 135.39 10.75 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 CA-C-O 120.91 0.386 . . . . 0.17 111.137 -175.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -141.96 127.0 18.38 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.458 -0.571 . . . . 0.41 109.458 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 29.2 m -115.64 131.72 56.85 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.139 0.422 . . . . 0.15 112.139 -172.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.819 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -99.98 129.9 49.94 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 N-CA-C 107.851 -1.166 . . . . 0.12 107.851 168.422 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 45' ' ' ILE . 97.3 t -93.01 121.29 43.59 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 O-C-N 121.148 -0.97 . . . . 0.11 108.577 173.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.482 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.52 -17.11 64.09 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.564 0.579 . . . . 0.08 112.564 -170.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.558 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 97.7 p -68.5 -19.49 64.54 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.964 -0.754 . . . . 0.87 108.964 174.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.7 p -109.21 15.55 23.12 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.897 -1.047 . . . . 0.15 109.994 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.512 HD13 ' HA2' ' A' ' 64' ' ' GLY . 22.2 mm -114.62 141.38 31.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.402 -0.592 . . . . 0.12 109.402 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -102.01 -47.91 4.41 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.799 -0.637 . . . . 0.52 110.648 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.701 ' O ' HD23 ' A' ' 48' ' ' LEU . 7.8 mtmm -141.86 169.56 17.35 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 120.599 0.238 . . . . 1.41 111.337 -177.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.93 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -141.26 154.34 45.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.72 -0.845 . . . . 0.73 108.72 175.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.624 ' HG3' HD11 ' A' ' 63' ' ' ILE . 23.5 mt-30 -135.74 145.55 46.74 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 109.365 -0.606 . . . . 1.94 109.365 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.475 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -137.92 134.74 35.34 Favored 'General case' 0 C--N 1.319 -0.746 0 O-C-N 121.726 -0.609 . . . . 0.22 110.672 175.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.454 HG21 ' HB3' ' A' ' 57' ' ' LYS . 68.8 p -59.99 119.08 38.4 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.801 -0.636 . . . . 0.26 110.704 -177.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.485 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 17.4 Cg_exo -57.21 162.19 9.97 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.664 2.242 . . . . 0.38 111.948 177.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.8 -19.6 64.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.084 -0.507 . . . . 0.66 110.899 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 45.7 t -82.59 -18.15 42.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.921 -0.581 . . . . 1.5 110.594 176.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.485 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 48.1 m -76.09 137.8 40.37 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.85 111.057 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.577 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 39.8 mt-10 -52.38 -35.38 51.42 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 122.038 0.923 . . . . 1.77 109.987 173.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.577 ' HD2' ' HB2' ' A' ' 56' ' ' GLU . 10.6 mptt -82.09 158.06 23.86 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.112 -1.404 . . . . 1.63 112.984 -169.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.403 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.3 OUTLIER -130.68 96.65 4.15 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.585 -1.189 . . . . 1.11 108.485 169.295 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.464 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.2 OUTLIER -155.16 154.43 32.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.237 0.541 . . . . 0.22 111.55 -173.799 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -131.0 120.68 23.84 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.452 -0.944 . . . . 0.1 108.452 177.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.586 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 14.1 mtp180 -104.6 145.11 30.78 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.036 0.446 . . . . 2.99 111.743 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.939 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -122.43 106.69 11.27 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.31 -0.859 . . . . 0.13 109.587 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.624 HD11 ' HG3' ' A' ' 49' ' ' GLN . 1.9 mp -85.19 99.39 7.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 C-N-CA 122.484 0.314 . . . . 0.29 110.211 -174.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.512 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -72.57 145.13 36.65 Favored Glycine 0 C--O 1.221 -0.689 0 C-N-CA 120.971 -0.633 . . . . 0.54 112.587 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.414 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 89.2 mttt . . . . . 0 C--N 1.318 -0.768 0 C-N-CA 122.692 0.397 . . . . 0.55 111.16 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.71 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 26.3 t70 . . . . . 0 C--O 1.218 -0.578 0 N-CA-C 108.469 -0.937 . . . . 3.23 108.469 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -64.84 -4.68 4.69 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.702 0.63 . . . . 2.39 112.702 -169.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.6 p -77.49 -4.04 43.52 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.08 0.467 . . . . 2.96 110.524 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.71 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -85.2 30.39 0.6 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.907 -0.588 . . . . 2.49 110.669 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.451 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 20.0 mtmt -46.82 114.81 0.9 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.262 0.553 . . . . 3.4 110.269 -174.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 55.6 ttt180 -89.11 168.62 12.18 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.611 -0.885 . . . . 3.8 108.611 -169.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.633 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 58.1 mttp -131.13 140.08 49.92 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 118.298 0.499 . . . . 4.29 110.625 174.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 75' ' ' ASN . 9.1 t70 -83.61 -173.07 4.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.763 -0.653 . . . . 4.41 110.323 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . 0.402 ' H ' ' CG ' ' A' ' 74' ' ' ASP . 29.7 m-80 -59.56 -31.63 69.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.212 0.53 . . . . 5.34 110.853 -177.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -87.35 1.43 53.34 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.969 -0.56 . . . . 5.38 110.789 -177.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.26 7.74 84.59 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.753 -0.737 . . . . 4.37 111.681 -175.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.633 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 51.1 m-20 -57.4 128.32 36.45 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 110.186 -0.301 . . . . 4.51 110.186 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -73.59 90.12 1.76 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.676 -0.491 . . . . 4.28 109.676 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.439 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 11.1 m -103.24 98.47 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-O 122.026 0.917 . . . . 3.1 109.618 -178.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.489 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.2 p -88.1 119.78 70.47 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-N 115.57 -0.741 . . . . 2.5 109.736 -178.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 31.4 Cg_exo . . . . . 0 CA--C 1.51 -0.712 0 C-N-CA 122.881 2.387 . . . . 1.87 112.588 -173.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.593 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 78.0 m-70 . . . . . 0 C--O 1.216 -0.661 0 N-CA-C 107.695 -1.224 . . . . 0.72 107.695 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.586 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 26.3 ttm -141.87 129.52 21.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 119.183 0.901 . . . . 0.27 111.77 174.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.488 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 4.7 m-85 -118.4 129.38 55.38 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.361 -0.836 . . . . 0.27 109.527 178.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.547 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.03 153.13 27.57 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 121.996 -0.44 . . . . 1.26 110.526 177.217 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.428 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.0 m-85 -133.59 172.53 12.62 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 0.32 111.133 -175.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -119.26 -11.58 9.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.567 -0.742 . . . . 2.38 109.804 177.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.513 ' HB2' HG23 ' A' ' 96' ' ' VAL . 41.5 m-80 -142.66 131.01 22.2 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.212 0.53 . . . . 1.1 110.633 -177.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.498 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.5 mmm180 -64.62 -34.2 77.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.196 -0.911 . . . . 3.09 111.938 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.2 m -62.75 -36.23 82.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.883 0.373 . . . . 0.35 110.824 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.566 ' O ' HG12 ' A' ' 100' ' ' ILE . 10.5 t -67.71 -56.11 14.41 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.399 0 CA-C-N 116.074 -0.512 . . . . 0.23 110.306 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.581 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.8 ptp -58.45 -37.83 76.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.088 -0.505 . . . . 0.17 111.041 -177.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -70.09 -26.25 63.89 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.973 -0.291 . . . . 0.34 111.085 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -85.93 -39.65 16.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.312 -0.403 . . . . 1.36 111.034 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.66 HG22 HD11 ' A' ' 104' ' ' LEU . 29.0 mm -64.98 -56.44 15.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 108.729 -0.841 . . . . 0.12 108.729 176.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.686 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.0 ttpt -48.31 -47.75 36.41 Favored 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 123.894 0.746 . . . . 0.79 110.161 175.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.724 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 36.2 ttp -50.89 -60.44 3.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.186 -0.915 . . . . 0.28 111.084 178.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.757 ' O ' HG13 ' A' ' 107' ' ' ILE . 86.6 m -55.95 -53.84 52.03 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 123.49 0.494 . . . . 0.18 110.75 -178.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.939 HD13 HD21 ' A' ' 62' ' ' LEU . 25.8 mt -46.54 -58.03 4.17 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.694 0.621 . . . . 0.09 110.261 176.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.529 ' HG3' HD12 ' A' ' 48' ' ' LEU . 70.4 mt-30 -52.69 -44.56 66.36 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.303 -0.862 . . . . 1.2 112.511 175.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.724 ' HG3' ' O ' ' A' ' 102' ' ' MET . 48.3 mt-30 -62.07 -30.65 71.13 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.709 0.766 . . . . 2.37 109.659 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.757 HG13 ' O ' ' A' ' 103' ' ' THR . 6.4 mt -81.75 -41.1 18.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 114.688 -1.142 . . . . 0.15 111.297 -177.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.778 HD11 HD21 ' A' ' 48' ' ' LEU . 5.2 mt -60.27 -42.2 89.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 112.948 0.721 . . . . 0.19 112.948 -174.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.648 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 2.1 p -65.81 -16.35 63.72 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.573 -0.451 . . . . 1.14 112.159 -175.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -63.06 -28.27 69.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.637 0.732 . . . . 1.64 109.096 169.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.558 ' CG ' ' HA ' ' A' ' 43' ' ' SER . 29.0 m-85 -110.41 10.83 23.32 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.95 -1.023 . . . . 0.65 110.309 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.648 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 9.2 mmpt? . . . . . 0 CA--C 1.511 -0.535 0 N-CA-C 108.648 -0.871 . . . . 0.76 108.648 171.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.442 ' CD2' HG21 ' A' ' 103' ' ' THR . 50.8 m80 . . . . . 0 CA--C 1.517 -0.316 0 N-CA-C 110.341 -0.244 . . . . 0.75 110.341 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 43.3 t -157.05 157.6 34.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.544 0.687 . . . . 1.09 112.409 -172.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.528 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.39 -167.16 37.0 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 109.813 -1.315 . . . . 0.16 109.813 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -93.73 135.62 34.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 118.008 0.904 . . . . 0.16 110.583 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.502 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -146.78 142.14 27.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.074 -0.512 . . . . 0.11 111.376 -177.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.789 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.0 mt -98.95 128.25 50.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 110.193 -0.299 . . . . 0.33 110.193 174.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.482 ' HE2' ' ND1' ' A' ' 38' ' ' HIS . 10.7 t80 -135.19 140.48 45.36 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.756 -0.831 . . . . 0.36 108.756 175.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 60.63 24.27 14.04 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.451 0.469 . . . . 0.8 109.87 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt 69.49 -2.75 1.81 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.018 0.927 . . . . 2.11 113.109 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -92.31 123.68 44.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 108.766 -0.828 . . . . 0.22 108.766 170.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.3 m -74.86 145.38 42.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.325 -0.398 . . . . 1.07 110.362 -176.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.01 -158.53 10.15 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 119.869 -1.158 . . . . 0.11 113.497 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.4 mm -125.3 131.5 72.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.456 -0.572 . . . . 0.13 109.456 -177.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.544 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -101.55 136.15 34.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 110.005 -0.369 . . . . 0.13 110.005 -177.297 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.49 131.31 31.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.608 0.242 . . . . 0.1 111.39 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.41 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 54.7 mt -86.21 138.41 19.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 121.211 0.529 . . . . 0.27 110.403 176.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -109.83 105.23 14.36 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.928 -1.033 . . . . 1.24 111.246 -175.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.437 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 36.5 mt-10 -116.99 170.35 8.7 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.902 -0.777 . . . . 1.2 108.902 175.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.437 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 36.3 t70 78.58 -5.01 2.09 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.38 1.086 . . . . 0.58 109.777 -177.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 23' ' ' SER . 31.1 m -102.62 -173.33 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 CA-C-N 113.872 -1.513 . . . . 0.25 109.824 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.649 ' O ' HG23 ' A' ' 22' ' ' VAL . 48.2 m -72.78 167.33 34.56 Favored Pre-proline 0 C--N 1.315 -0.914 0 N-CA-C 105.322 -2.103 . . . . 1.13 105.322 174.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -41.49 127.62 3.28 Favored 'Trans proline' 0 C--N 1.352 0.736 0 CA-C-N 121.13 1.439 . . . . 0.16 112.534 -142.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.474 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -49.64 140.25 11.41 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 113.919 -1.491 . . . . 0.1 112.434 -165.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -125.43 169.48 12.34 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 114.09 -1.414 . . . . 0.32 111.585 -168.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.794 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -118.89 105.64 11.7 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 107.612 -1.255 . . . . 0.09 107.612 173.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 m -100.67 106.48 17.94 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-O 120.973 0.416 . . . . 0.17 110.743 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.3 t90 -85.01 132.02 34.39 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.91 -0.774 . . . . 0.14 108.91 171.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.503 ' HG2' HG23 ' A' ' 37' ' ' VAL . 93.6 mtt180 -126.0 159.74 31.89 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.258 -0.645 . . . . 1.91 109.258 174.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 p -70.71 177.68 3.44 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 110.077 -0.342 . . . . 0.6 110.077 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 p -64.79 -23.19 67.16 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.398 -0.521 . . . . 0.26 111.479 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -99.4 -31.63 11.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.644 0.735 . . . . 2.12 109.054 169.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.466 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 98.49 16.59 31.39 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 114.712 -1.131 . . . . 0.23 112.153 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -67.19 -39.63 86.4 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.263 -0.643 . . . . 1.73 109.263 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.8 tttm -93.68 141.21 28.74 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.412 -0.959 . . . . 1.3 108.412 175.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.503 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.1 p -147.31 136.89 16.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 120.963 0.411 . . . . 0.17 111.007 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.482 ' ND1' ' HE2' ' A' ' 9' ' ' PHE . 3.3 t60 -143.67 118.07 9.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.275 -0.421 . . . . 0.41 109.941 -178.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 24.7 m -110.79 133.79 53.05 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.409 0.522 . . . . 0.15 112.409 -173.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.794 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.63 130.24 54.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 N-CA-C 108.103 -1.073 . . . . 0.12 108.103 168.543 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 90.4 t -93.34 120.4 42.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 O-C-N 121.202 -0.936 . . . . 0.11 108.754 173.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.553 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -68.14 -19.4 64.81 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.231 0.826 . . . . 0.08 113.231 -169.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.564 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 9.8 p -70.2 -13.45 62.19 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.336 0.589 . . . . 0.87 109.641 175.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.4 p -108.66 11.28 26.63 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.477 -0.783 . . . . 0.15 109.583 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.531 HG21 ' CD1' ' A' ' 62' ' ' LEU . 26.3 mm -113.83 144.68 20.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.102 -0.703 . . . . 0.12 109.102 178.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -110.77 -41.79 4.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.78 0.324 . . . . 0.52 110.968 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.528 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 14.9 mtmt -140.33 174.39 10.56 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.106 0.479 . . . . 1.41 111.029 -179.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.595 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -152.49 134.73 15.04 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.673 -0.862 . . . . 0.73 108.673 -178.106 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -133.45 115.19 14.5 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 122.268 -0.27 . . . . 1.94 111.289 -170.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.457 ' HB2' ' HG ' ' A' ' 60' ' ' LEU . . . -114.8 146.67 40.77 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.179 -0.326 . . . . 0.22 111.802 -175.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.42 ' CG2' ' HB2' ' A' ' 59' ' ' MET . 80.5 p -72.44 120.91 83.15 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 115.922 -0.581 . . . . 0.26 110.921 -176.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.604 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 10.0 Cg_exo -62.3 165.96 13.98 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.832 2.355 . . . . 0.38 111.921 175.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.89 -27.25 67.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.042 -0.526 . . . . 0.66 111.313 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.5 m -84.91 -4.84 59.28 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.87 -0.605 . . . . 1.5 110.772 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.604 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 35.2 m -82.64 148.53 27.91 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.03 -0.532 . . . . 0.85 111.635 178.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -70.52 7.04 1.17 Allowed 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.169 -0.923 . . . . 1.77 111.909 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.475 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 40.7 mmtm -130.26 153.3 48.76 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 115.171 -0.922 . . . . 1.63 111.204 -167.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.462 ' O ' ' HG3' ' A' ' 59' ' ' MET . 80.1 mmm -125.61 97.23 5.08 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.565 -0.902 . . . . 1.11 108.565 167.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.475 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.28 156.32 35.33 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.242 0.544 . . . . 0.22 111.983 -172.538 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.54 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.3 tt -135.17 118.88 17.11 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.435 -0.95 . . . . 0.1 108.435 177.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.736 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.2 mtp180 -101.85 144.6 30.3 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.342 0.591 . . . . 2.99 111.748 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.899 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -120.24 110.19 16.29 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.776 -1.102 . . . . 0.13 108.863 178.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.492 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.4 mp -88.88 100.91 11.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.135 0.493 . . . . 0.29 110.475 -172.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.448 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -71.22 141.02 31.91 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.652 -0.704 . . . . 0.54 112.615 -177.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.461 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 79.7 mttt . . . . . 0 C--N 1.318 -0.763 0 N-CA-C 112.992 0.738 . . . . 0.55 112.992 -174.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.505 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 5.3 m-20 . . . . . 0 C--O 1.215 -0.751 0 N-CA-C 108.687 -0.856 . . . . 3.23 108.687 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 43.1 mt-10 -65.02 -2.58 2.8 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.606 0.241 . . . . 2.39 111.618 -175.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . 0.422 ' C ' ' H ' ' A' ' 71' ' ' LYS . 12.9 p -69.6 -13.26 62.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.388 0.613 . . . . 2.96 109.761 169.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.543 ' NZ ' ' HG2' ' A' ' 82' ' ' PRO . 13.6 ptmm? -75.34 29.69 0.1 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.164 -0.926 . . . . 2.49 110.797 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 20.0 mtmt -48.09 114.66 0.97 Allowed 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.369 0.604 . . . . 3.4 109.835 -174.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.528 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 79.3 ttt180 -92.91 165.65 12.78 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 114.976 -1.011 . . . . 3.8 108.838 -171.333 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.42 ' HD3' ' O ' ' A' ' 77' ' ' GLY . 54.9 mttp -127.11 139.34 53.05 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.302 0.572 . . . . 4.29 109.919 171.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.432 ' CG ' ' H ' ' A' ' 75' ' ' ASN . 13.7 t70 -91.79 -165.33 1.33 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.175 -0.92 . . . . 4.41 110.368 -174.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . 0.432 ' H ' ' CG ' ' A' ' 74' ' ' ASP . 78.9 m-20 -62.71 -33.17 74.56 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.375 0.509 . . . . 5.34 112.375 -169.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -84.28 1.62 43.97 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 111.67 0.248 . . . . 5.38 111.67 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.42 ' O ' ' HD3' ' A' ' 73' ' ' LYS . . . 79.72 4.33 89.34 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.55 -0.833 . . . . 4.37 111.422 -175.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -72.01 140.49 49.09 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.921 -0.4 . . . . 4.51 109.921 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -68.98 116.87 9.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.105 -0.498 . . . . 4.28 110.879 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 9.8 m -122.47 98.85 6.13 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 108.877 -0.786 . . . . 3.1 108.877 173.021 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 1.2 p -86.31 109.94 27.34 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-O 121.235 0.541 . . . . 2.5 110.126 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.543 ' HG2' ' NZ ' ' A' ' 70' ' ' LYS . 52.5 Cg_exo . . . . . 0 CA--C 1.513 -0.547 0 C-N-CA 123.549 2.833 . . . . 1.87 112.279 -177.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.515 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 67.1 m-70 . . . . . 0 C--O 1.219 -0.527 0 N-CA-C 106.954 -1.499 . . . . 0.72 106.954 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.736 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 15.6 ttm -140.09 125.98 19.54 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 119.403 1.001 . . . . 0.27 111.814 175.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.473 ' O ' ' HA ' ' A' ' 59' ' ' MET . 15.8 m-85 -108.12 158.07 17.74 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.965 -1.016 . . . . 0.27 108.72 176.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.789 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -106.69 157.6 17.59 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 108.806 -0.812 . . . . 1.26 108.806 175.455 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.54 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 30.9 m-85 -139.39 170.46 15.88 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.011 0.434 . . . . 0.32 111.615 -176.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -123.86 -5.78 7.98 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.593 -0.731 . . . . 2.38 110.379 176.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.43 ' HB2' HG23 ' A' ' 96' ' ' VAL . 50.6 m-80 -147.13 126.15 12.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.041 -0.527 . . . . 1.1 109.918 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.631 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 13.8 mmm180 -61.52 -35.4 77.62 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 116.011 -0.541 . . . . 3.09 110.994 177.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -56.85 -36.2 69.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.186 -0.461 . . . . 0.35 110.423 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.633 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.6 t -69.18 -60.26 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.022 -0.536 . . . . 0.23 110.329 176.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.631 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.5 ptp -57.93 -40.14 79.71 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 116.578 -0.283 . . . . 0.17 110.813 -176.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.487 ' N ' ' HG3' ' A' ' 97' ' ' MET . 35.2 t70 -58.92 -44.44 91.31 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.477 -0.489 . . . . 0.34 110.381 176.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -72.24 -42.4 65.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.303 -0.408 . . . . 1.36 111.927 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.633 HG12 ' O ' ' A' ' 96' ' ' VAL . 27.3 mm -61.94 -56.94 14.49 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 N-CA-C 108.833 -0.802 . . . . 0.12 108.833 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.737 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.7 ttpt -49.43 -52.69 27.22 Favored 'General case' 0 C--O 1.216 -0.683 0 O-C-N 123.934 0.771 . . . . 0.79 109.762 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.557 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 39.1 ttp -48.17 -53.28 17.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.121 -0.945 . . . . 0.28 111.474 178.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.732 ' O ' HG13 ' A' ' 107' ' ' ILE . 85.6 m -60.64 -54.51 44.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.134 -0.484 . . . . 0.18 110.483 178.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.899 HD13 HD21 ' A' ' 62' ' ' LEU . 24.9 mt -47.9 -54.54 12.33 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.782 0.676 . . . . 0.09 110.63 177.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.567 ' HG2' HD13 ' A' ' 48' ' ' LEU . 94.1 mt-30 -49.02 -49.0 43.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.391 -1.277 . . . . 1.2 111.923 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 102' ' ' MET . 27.6 mm-40 -67.77 -28.38 67.56 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.451 0.643 . . . . 2.37 110.556 -177.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.732 HG13 ' O ' ' A' ' 103' ' ' THR . 8.2 mt -75.87 -41.18 39.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-N 115.128 -0.942 . . . . 0.15 110.642 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.534 HD12 HD11 ' A' ' 48' ' ' LEU . 7.5 mt -65.16 -40.58 89.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.387 -0.369 . . . . 0.19 111.614 -178.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.2 p -61.02 -18.91 60.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.838 0.351 . . . . 1.14 111.517 -177.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -66.58 -48.71 68.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.311 0.577 . . . . 1.64 109.443 173.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.564 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 15.4 m-85 -77.48 -22.68 50.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.316 -0.857 . . . . 0.65 109.859 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 115.019 -0.991 . . . . 0.76 109.911 177.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.515 ' HA ' HD12 ' A' ' 18' ' ' ILE . 41.7 m80 . . . . . 0 CA--C 1.511 -0.546 0 N-CA-C 109.704 -0.48 . . . . 0.75 109.704 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.8 p -158.29 164.68 36.18 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 119.749 -0.78 . . . . 1.09 112.648 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.444 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 176.76 -163.75 32.91 Favored Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 114.692 -1.14 . . . . 0.16 110.916 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.83 135.72 43.97 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.677 -0.49 . . . . 0.16 109.677 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.508 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -148.54 143.01 26.36 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.039 0.447 . . . . 0.11 111.756 -175.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 13' ' ' SER . 89.1 mt -106.63 124.21 62.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.22 -0.446 . . . . 0.33 110.226 177.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -127.35 140.75 51.98 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 108.682 -0.858 . . . . 0.36 108.682 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 54.36 25.62 6.16 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.636 0.375 . . . . 0.8 111.113 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm 65.49 14.44 9.47 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.801 0.667 . . . . 2.11 112.801 -177.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.441 HG13 ' CH2' ' A' ' 29' ' ' TRP . 2.1 p -103.97 121.72 55.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 108.428 -0.953 . . . . 0.22 108.428 166.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.489 ' HA ' HG12 ' A' ' 8' ' ' ILE . 50.1 p -75.49 144.38 42.05 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.379 -0.373 . . . . 1.07 110.85 -175.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.438 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.96 -160.01 10.64 Favored Glycine 0 N--CA 1.437 -1.243 0 C-N-CA 120.256 -0.973 . . . . 0.11 113.527 -177.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.7 mm -126.12 132.19 70.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 109.296 -0.631 . . . . 0.13 109.296 -177.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.553 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.37 136.39 34.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 120.684 0.278 . . . . 0.13 110.477 -175.664 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.24 127.26 25.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.92 0.391 . . . . 0.1 111.76 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.515 HD12 ' HA ' ' A' ' 3' ' ' HIS . 57.8 mt -86.11 135.51 24.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.757 -0.461 . . . . 0.27 109.757 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -110.32 106.72 16.2 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.164 -0.471 . . . . 1.24 110.989 -175.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.442 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 30.4 mt-10 -117.35 170.25 8.86 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.848 -0.797 . . . . 1.2 108.848 174.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.442 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 34.6 t70 78.04 -3.98 2.28 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 122.342 1.068 . . . . 0.58 109.737 -176.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' ' 23' ' ' SER . 32.9 m -103.09 -174.07 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-N 113.96 -1.473 . . . . 0.25 109.651 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.598 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.8 m -72.35 164.66 57.78 Favored Pre-proline 0 C--N 1.316 -0.868 0 N-CA-C 104.997 -2.223 . . . . 1.13 104.997 174.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.408 ' O ' HG13 ' A' ' 41' ' ' VAL . 82.2 Cg_exo -41.45 128.79 3.46 Favored 'Trans proline' 0 C--N 1.353 0.785 0 CA-C-N 120.949 1.374 . . . . 0.16 112.744 -141.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -47.66 141.3 5.46 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 113.919 -1.491 . . . . 0.1 112.703 -165.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -127.71 164.7 21.54 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 114.382 -1.281 . . . . 0.32 111.731 -169.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.719 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -115.48 105.44 12.81 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 107.55 -1.278 . . . . 0.09 107.55 173.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.0 m -100.39 106.71 18.33 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 120.941 0.4 . . . . 0.17 110.57 -176.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.441 ' CH2' HG13 ' A' ' 12' ' ' VAL . 82.7 t90 -84.67 131.72 34.55 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.801 -0.815 . . . . 0.14 108.801 172.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.561 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 36.8 mtm180 -122.66 160.86 24.93 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.824 -0.806 . . . . 1.91 108.824 175.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -72.38 178.1 4.18 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.995 -0.743 . . . . 0.6 108.995 175.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.438 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 5.1 p -60.43 -31.25 70.23 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.307 -0.557 . . . . 0.26 111.046 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -94.6 -24.27 17.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.785 0.802 . . . . 2.12 109.686 172.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.561 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 88.32 16.76 58.48 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 114.762 -1.108 . . . . 0.23 111.591 -178.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -65.69 -41.43 92.39 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.052 -0.722 . . . . 1.73 109.052 175.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.6 tttt -91.98 140.86 29.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.03 -0.987 . . . . 1.3 108.361 171.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.482 HG23 ' HG2' ' A' ' 30' ' ' ARG . 11.1 p -148.48 135.96 13.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.812 0.339 . . . . 0.17 110.639 -178.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -143.65 124.99 14.65 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.966 -0.383 . . . . 0.41 109.966 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.3 m -110.81 141.14 44.55 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.144 0.424 . . . . 0.15 112.144 -173.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.719 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -111.09 129.22 66.76 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 N-CA-C 108.037 -1.097 . . . . 0.12 108.037 168.163 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.46 ' O ' HG12 ' A' ' 45' ' ' ILE . 94.3 t -93.01 121.41 43.68 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 O-C-N 120.991 -1.068 . . . . 0.11 108.973 173.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.572 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -68.75 -21.22 64.38 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.098 0.777 . . . . 0.08 113.098 -169.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 p -68.23 -15.98 63.79 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.383 0.611 . . . . 0.87 109.386 175.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.482 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 5.1 p -111.18 14.29 21.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.395 -0.82 . . . . 0.15 110.079 -178.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.559 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.3 mm -112.41 139.05 39.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.961 -0.755 . . . . 0.12 108.961 177.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -105.23 -43.84 4.91 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.181 -0.463 . . . . 0.52 110.586 -175.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 26.7 mtpt -133.07 169.09 17.34 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 121.334 0.588 . . . . 1.41 111.292 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.898 HD11 HD12 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -150.77 146.34 26.33 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.909 -1.041 . . . . 0.73 108.998 176.57 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.681 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 11.6 mm-40 -134.5 145.23 48.59 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.979 -0.378 . . . . 1.94 109.979 -173.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.593 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -142.12 132.69 25.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 118.135 0.425 . . . . 0.22 111.032 174.136 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.46 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 82.6 p -64.98 118.03 45.03 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.508 -0.769 . . . . 0.26 110.704 -176.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -54.86 160.23 7.99 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 123.057 2.505 . . . . 0.38 112.34 177.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.03 -12.87 61.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.06 -0.518 . . . . 0.66 111.438 -178.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.9 m -89.16 -19.23 25.73 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.219 0.533 . . . . 1.5 110.558 174.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.9 m -72.57 141.3 48.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.553 -0.749 . . . . 0.85 111.005 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.5 -6.42 19.55 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.408 -0.815 . . . . 1.77 111.151 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.425 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 9.0 mptt -107.65 159.81 16.18 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.957 -1.02 . . . . 1.63 111.716 -175.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.46 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 3.1 mtp -131.91 98.3 4.41 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 114.636 -1.165 . . . . 1.11 108.778 168.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.446 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.1 OUTLIER -154.89 155.36 34.19 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.727 -0.67 . . . . 0.22 112.15 -172.364 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.511 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -135.11 119.05 17.36 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.659 -1.155 . . . . 0.1 108.302 177.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.7 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 6.4 mtp180 -104.25 138.04 41.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.232 0.539 . . . . 2.99 111.171 -178.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.922 HD21 HD13 ' A' ' 104' ' ' LEU . 1.6 mm? -115.9 106.02 13.34 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.34 -0.845 . . . . 0.13 109.252 176.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.497 HD12 ' N ' ' A' ' 63' ' ' ILE . 3.0 mp -88.67 108.33 18.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 110.318 -0.253 . . . . 0.29 110.318 -173.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.408 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -63.58 157.82 40.81 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.135 -0.555 . . . . 0.54 112.659 179.14 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 82.8 mttt . . . . . 0 C--N 1.321 -0.672 0 CA-C-O 121.018 0.437 . . . . 0.55 111.184 -179.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.446 ' HB2' ' HD2' ' A' ' 70' ' ' LYS . 23.8 m-20 . . . . . 0 N--CA 1.445 -0.717 0 N-CA-C 108.156 -1.053 . . . . 3.23 108.156 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -70.26 -2.84 14.56 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.249 0.547 . . . . 2.39 111.044 -174.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.3 p -91.37 -3.72 56.46 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.621 -0.718 . . . . 2.96 110.601 173.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 8.5 ptmm? -83.19 27.89 0.55 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.206 -0.452 . . . . 2.49 110.459 -177.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.544 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 29.3 mmtm -44.86 113.38 0.55 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.542 -0.754 . . . . 3.4 110.94 -170.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.527 ' HB3' HG23 ' A' ' 80' ' ' VAL . 72.3 ttt180 -98.04 165.93 11.67 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 108.174 -1.047 . . . . 3.8 108.174 178.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.595 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 63.1 mttp -134.01 140.83 46.96 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.704 -0.48 . . . . 4.29 109.704 172.57 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.479 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.5 OUTLIER -79.09 -172.07 2.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.642 -0.708 . . . . 4.41 110.057 -178.237 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . 0.411 HD22 ' N ' ' A' ' 75' ' ' ASN . 0.9 OUTLIER -62.15 -31.84 72.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.616 0.246 . . . . 5.34 111.327 -179.109 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.479 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 26.0 mt-10 -78.79 -31.53 46.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.701 0.286 . . . . 5.38 110.798 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 114.65 17.09 7.16 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.786 -0.721 . . . . 4.37 112.635 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.595 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 38.1 m-80 -74.07 134.05 42.92 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.571 -0.529 . . . . 4.51 109.571 177.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -72.01 91.41 1.22 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.568 -0.53 . . . . 4.28 109.568 178.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.527 HG23 ' HB3' ' A' ' 72' ' ' ARG . 27.2 m -93.25 100.76 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.902 0 CA-C-O 122.035 0.922 . . . . 3.1 109.885 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.544 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.5 p -94.82 106.27 23.75 Favored Pre-proline 0 C--N 1.319 -0.73 0 CA-C-N 115.554 -0.748 . . . . 2.5 109.612 177.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 36.6 Cg_exo . . . . . 0 C--O 1.233 0.23 0 C-N-CA 123.366 2.711 . . . . 1.87 113.212 -171.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.568 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 52.9 m-70 . . . . . 0 C--O 1.218 -0.562 0 N-CA-C 108.974 -0.75 . . . . 0.72 108.974 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.7 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 24.1 ttm -108.27 118.97 38.16 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 119.898 -0.721 . . . . 0.27 111.341 -177.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.508 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.3 m-85 -109.53 128.54 55.27 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.2 -0.909 . . . . 0.27 109.905 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.473 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.59 151.09 27.83 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 110.038 -0.356 . . . . 1.26 110.038 176.058 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.413 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 20.7 m-85 -130.54 174.43 9.9 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.362 0.601 . . . . 0.32 111.69 -173.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -115.42 -19.54 10.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.103 -0.953 . . . . 2.38 110.878 177.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.428 ' HB2' HG23 ' A' ' 96' ' ' VAL . 46.5 m-80 -142.61 133.56 25.71 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.423 0.63 . . . . 1.1 110.926 -178.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.504 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.7 mmm180 -61.46 -35.52 77.86 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.713 -1.131 . . . . 3.09 112.063 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.9 m -62.85 -34.14 76.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.735 0.302 . . . . 0.35 110.775 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.548 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.0 t -69.2 -57.06 9.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.299 -0.41 . . . . 0.23 110.328 178.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.511 ' HA ' HD12 ' A' ' 60' ' ' LEU . 12.6 ptp -57.96 -38.69 76.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.056 -0.52 . . . . 0.17 111.39 -176.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 97' ' ' MET . 15.6 t70 -67.63 -37.46 82.49 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.996 -0.282 . . . . 0.34 110.297 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.467 ' HA ' ' HE2' ' A' ' 102' ' ' MET . 4.2 m-80 -72.56 -43.03 64.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.242 -0.435 . . . . 1.36 111.163 178.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.655 HG22 HD11 ' A' ' 104' ' ' LEU . 32.4 mm -62.42 -56.62 16.41 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 N-CA-C 108.849 -0.797 . . . . 0.12 108.849 177.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.817 ' HA ' HD12 ' A' ' 104' ' ' LEU . 12.3 ttpp -51.34 -46.24 62.6 Favored 'General case' 0 C--O 1.22 -0.481 0 O-C-N 123.693 0.621 . . . . 0.79 110.112 177.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.646 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 38.2 ttp -50.3 -59.69 3.72 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.669 -0.696 . . . . 0.28 111.175 177.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.78 ' O ' HG13 ' A' ' 107' ' ' ILE . 35.5 m -57.39 -52.81 63.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.212 -0.449 . . . . 0.18 110.546 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.922 HD13 HD21 ' A' ' 62' ' ' LEU . 26.4 mt -45.8 -55.35 6.7 Favored 'General case' 0 C--O 1.223 -0.336 0 O-C-N 123.685 0.615 . . . . 0.09 110.313 174.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.671 ' CG ' HD13 ' A' ' 48' ' ' LEU . 23.7 mt-30 -55.75 -43.93 77.13 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.877 -1.056 . . . . 1.2 112.484 177.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.646 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.4 mt-30 -62.12 -32.43 73.0 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.877 0.846 . . . . 2.37 108.862 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.78 HG13 ' O ' ' A' ' 103' ' ' THR . 9.8 mt -78.63 -46.68 24.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 114.284 -1.325 . . . . 0.15 111.116 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.898 HD12 HD11 ' A' ' 48' ' ' LEU . 7.9 mt -61.8 -39.52 83.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.074 -0.512 . . . . 0.19 111.675 -177.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.0 t -60.17 -26.82 66.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.653 0.263 . . . . 1.14 111.065 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -65.64 -43.82 88.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.537 0.684 . . . . 1.64 109.249 174.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -91.53 12.04 22.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.65 109.759 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? . . . . . 0 C--N 1.321 -0.641 0 CA-C-N 114.75 -1.113 . . . . 0.76 108.118 173.467 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.565 ' HA ' HD12 ' A' ' 18' ' ' ILE . 75.3 m80 . . . . . 0 N--CA 1.473 0.692 0 N-CA-C 111.656 0.243 . . . . 0.75 111.656 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 p -158.68 165.86 33.39 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.085 -0.646 . . . . 1.09 112.171 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.499 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 175.57 -165.77 36.78 Favored Glycine 0 N--CA 1.44 -1.081 0 CA-C-N 114.971 -1.013 . . . . 0.16 110.915 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.3 134.1 46.13 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 117.153 0.476 . . . . 0.16 110.009 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.583 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -146.56 148.61 32.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.623 -0.262 . . . . 0.11 111.656 -176.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.802 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 61.6 mt -109.39 122.83 64.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.952 0.406 . . . . 0.33 110.719 176.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.414 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.3 t80 -125.59 134.16 52.02 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.785 -0.82 . . . . 0.36 108.785 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 59.52 26.61 15.62 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.777 0.431 . . . . 0.8 110.543 -177.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt 69.56 1.06 3.19 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.825 0.85 . . . . 2.11 113.125 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.414 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.5 OUTLIER -92.45 123.77 44.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 108.418 -0.956 . . . . 0.22 108.418 167.842 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.3 m -75.9 145.77 40.24 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.901 0.381 . . . . 1.07 110.234 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.6 -160.82 11.17 Favored Glycine 0 N--CA 1.437 -1.297 0 C-N-CA 120.317 -0.944 . . . . 0.11 112.944 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.5 mm -125.28 135.04 65.29 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.217 -0.661 . . . . 0.13 109.217 -178.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.595 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -104.08 135.5 41.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 110.133 -0.321 . . . . 0.13 110.133 -175.493 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.69 129.2 30.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.928 0.394 . . . . 0.1 111.594 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.565 HD12 ' HA ' ' A' ' 3' ' ' HIS . 58.5 mt -86.11 134.98 26.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 109.812 -0.44 . . . . 0.27 109.812 177.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -111.33 103.57 11.97 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.245 -0.434 . . . . 1.24 111.303 -173.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.455 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 30.9 mt-10 -114.95 170.32 8.43 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.435 -0.95 . . . . 1.2 108.435 173.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.455 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.1 t70 80.77 -5.84 1.69 Allowed 'General case' 0 N--CA 1.484 1.225 0 CA-C-O 122.393 1.092 . . . . 0.58 109.472 -176.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 23' ' ' SER . 26.4 m -102.74 -173.18 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-N 113.732 -1.576 . . . . 0.25 109.107 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.627 ' O ' HG23 ' A' ' 22' ' ' VAL . 30.5 m -72.15 168.12 25.95 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 105.549 -2.019 . . . . 1.13 105.549 175.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.411 ' O ' HG13 ' A' ' 41' ' ' VAL . 68.8 Cg_exo -40.76 128.36 2.64 Favored 'Trans proline' 0 C--N 1.359 1.095 0 CA-C-N 121.288 1.496 . . . . 0.16 112.518 -145.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.517 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -49.24 140.39 9.9 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 114.215 -1.357 . . . . 0.1 112.534 -164.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.29 166.47 15.84 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.353 -1.294 . . . . 0.32 111.862 -170.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.768 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -115.84 107.3 14.85 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 107.633 -1.247 . . . . 0.09 107.633 173.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.1 m -104.16 106.94 17.62 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 120.82 0.343 . . . . 0.17 111.301 -174.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 86.2 t90 -85.21 130.44 34.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.942 -0.762 . . . . 0.14 108.942 172.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.454 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 61.4 mtt180 -125.16 156.7 37.98 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 108.77 -0.826 . . . . 1.91 108.77 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -66.0 174.47 2.47 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.301 -0.629 . . . . 0.6 109.301 178.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.1 p -58.02 -36.92 73.38 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.408 -0.517 . . . . 0.26 110.681 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -87.67 -32.26 19.32 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.558 0.694 . . . . 2.12 109.716 172.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.454 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 100.29 12.78 37.93 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 114.922 -1.036 . . . . 0.23 112.825 176.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -66.68 -36.53 82.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.36 0.6 . . . . 1.73 109.895 176.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -95.68 137.82 34.2 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.414 -0.958 . . . . 1.3 108.414 174.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 14.6 p -150.48 136.31 11.54 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-O 120.994 0.426 . . . . 0.17 111.391 -177.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -143.71 128.8 18.64 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.634 -0.506 . . . . 0.41 109.634 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 30.4 m -114.37 140.86 48.31 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.033 0.383 . . . . 0.15 112.033 -172.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.768 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -107.89 128.97 62.77 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 N-CA-C 108.18 -1.044 . . . . 0.12 108.18 168.383 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 45' ' ' ILE . 99.8 t -92.3 118.78 38.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 121.228 -0.92 . . . . 0.11 108.963 173.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.568 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -67.56 -18.55 65.05 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.866 0.691 . . . . 0.08 112.866 -170.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.537 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 80.4 p -68.18 -18.3 64.56 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.177 -0.675 . . . . 0.87 109.177 176.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.9 p -109.99 13.21 23.45 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.886 -1.052 . . . . 0.15 110.206 -177.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.554 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 27.4 mm -111.63 140.47 30.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.054 -0.521 . . . . 0.12 109.657 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -106.86 -43.99 4.54 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.882 -0.599 . . . . 0.52 110.839 -175.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.537 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 40.4 mtpt -133.57 172.26 12.98 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.411 0.624 . . . . 1.41 111.537 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.657 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -151.08 148.95 28.94 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.939 -1.028 . . . . 0.73 108.882 174.8 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.515 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 5.4 mm-40 -136.34 153.36 51.16 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.381 -0.6 . . . . 1.94 109.381 -176.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.463 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -145.66 140.36 27.24 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 118.278 0.49 . . . . 0.22 110.917 176.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 76.2 p -71.08 118.21 63.56 Favored Pre-proline 0 C--O 1.234 0.258 0 CA-C-N 116.134 -0.485 . . . . 0.26 111.272 -176.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.466 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 17.4 Cg_exo -56.82 160.69 11.62 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.867 2.378 . . . . 0.38 112.299 177.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.56 -20.88 66.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.697 -0.683 . . . . 0.66 111.871 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.8 m -85.9 -18.07 33.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.203 0.525 . . . . 1.5 111.067 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.466 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 35.1 m -68.93 143.34 54.48 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.527 -0.76 . . . . 0.85 112.263 -177.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -58.18 -26.76 63.15 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 114.639 -1.164 . . . . 1.77 110.975 171.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.518 ' HB3' ' HE1' ' A' ' 59' ' ' MET . 68.1 mmtt -91.73 153.05 19.89 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.948 -1.478 . . . . 1.63 111.984 -169.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.577 ' O ' ' HG3' ' A' ' 59' ' ' MET . 80.0 mmm -127.16 96.16 4.51 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.317 -0.994 . . . . 1.11 108.317 167.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.577 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -158.52 158.34 33.83 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.581 0.705 . . . . 0.22 112.226 -173.326 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.536 HD12 ' HA ' ' A' ' 97' ' ' MET . 2.4 tt -135.43 120.62 18.91 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.662 -1.154 . . . . 0.1 108.121 176.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.624 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 1.0 OUTLIER -102.94 146.34 28.47 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.307 0.575 . . . . 2.99 111.591 -177.697 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.938 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -125.62 106.18 9.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.847 -1.07 . . . . 0.13 108.952 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.537 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.4 mp -87.73 105.85 15.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-O 120.695 0.283 . . . . 0.29 110.532 -172.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -74.89 147.66 36.93 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.306 -0.474 . . . . 0.54 113.062 -177.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.554 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 90.1 mttt . . . . . 0 C--N 1.323 -0.583 0 C-N-CA 122.922 0.489 . . . . 0.55 111.945 -178.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.617 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 4.7 m-20 . . . . . 0 C--O 1.221 -0.415 0 N-CA-C 108.835 -0.802 . . . . 3.23 108.835 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.69 -6.34 7.65 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.328 0.492 . . . . 2.39 112.328 -172.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.0 p -69.39 -8.45 46.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.387 0.613 . . . . 2.96 110.106 172.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.617 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.2 ptpt -82.92 33.21 0.43 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.489 -0.778 . . . . 2.49 111.226 178.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.1 mtmm -46.63 114.21 0.78 Allowed 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.277 -0.638 . . . . 3.4 109.277 -177.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.51 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.8 ttt180 -96.65 161.55 13.84 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.012 -0.994 . . . . 3.8 109.005 -168.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.57 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 98.8 mttt -129.23 146.56 51.11 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 109.669 -0.493 . . . . 4.29 109.669 173.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.476 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 1.1 p-10 -81.48 -168.85 2.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.993 -0.549 . . . . 4.41 110.52 -177.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -59.37 -32.04 69.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.665 -0.243 . . . . 5.34 111.629 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.476 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 16.5 mt-10 -82.67 -41.51 19.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.093 0.473 . . . . 5.38 110.648 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 127.12 16.0 2.45 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.737 -0.744 . . . . 4.37 112.145 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.57 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 37.1 m-80 -73.11 138.18 45.65 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.63 -0.507 . . . . 4.51 109.63 178.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -75.14 93.32 2.77 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.203 -0.453 . . . . 4.28 110.401 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.51 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 14.7 m -103.91 99.45 8.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.466 0.65 . . . . 3.1 109.309 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.471 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 p -92.41 111.84 52.49 Favored Pre-proline 0 C--N 1.316 -0.889 0 CA-C-O 121.366 0.603 . . . . 2.5 110.655 -177.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 39.1 Cg_exo . . . . . 0 N--CA 1.46 -0.472 0 C-N-CA 123.114 2.543 . . . . 1.87 112.082 -178.874 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.515 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 75.1 m-70 . . . . . 0 C--O 1.22 -0.496 0 N-CA-C 107.217 -1.401 . . . . 0.72 107.217 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.624 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 26.6 ttm -141.94 131.84 24.41 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 119.033 0.833 . . . . 0.27 111.204 175.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.529 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.5 m-85 -120.97 134.64 55.3 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.471 -0.786 . . . . 0.27 109.529 178.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.802 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -79.99 159.39 26.27 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.507 -0.553 . . . . 1.26 109.507 178.071 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 16.7 m-85 -138.4 175.16 9.81 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.349 0.595 . . . . 0.32 112.151 -177.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.1 p-10 -116.94 -20.55 9.34 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.111 -0.95 . . . . 2.38 110.843 178.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -145.87 143.77 29.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.91 0.385 . . . . 1.1 110.451 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.544 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.2 OUTLIER -73.84 -28.56 61.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.831 -0.622 . . . . 3.09 111.835 -176.739 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.3 m -63.9 -38.53 91.41 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.757 0.313 . . . . 0.35 110.823 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.2 t -63.55 -56.85 14.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.324 -0.398 . . . . 0.23 110.273 178.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.544 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 15.7 ptp -58.58 -39.54 80.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.834 -0.621 . . . . 0.17 111.21 -176.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.7 -41.0 98.9 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 120.675 -0.41 . . . . 0.34 110.331 177.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -71.17 -39.29 71.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.271 -0.422 . . . . 1.36 111.71 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.638 HG22 HD11 ' A' ' 104' ' ' LEU . 34.2 mm -64.99 -56.2 16.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 108.858 -0.793 . . . . 0.12 108.858 175.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.804 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.8 ttpt -51.57 -45.62 63.16 Favored 'General case' 0 C--O 1.223 -0.293 0 O-C-N 123.911 0.757 . . . . 0.79 110.232 177.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.486 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 41.3 ttp -51.87 -54.18 32.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.28 -0.873 . . . . 0.28 111.099 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.726 ' O ' HG13 ' A' ' 107' ' ' ILE . 24.4 m -62.33 -52.16 64.76 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.179 -0.464 . . . . 0.18 110.395 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.938 HD13 HD21 ' A' ' 62' ' ' LEU . 27.0 mt -46.97 -54.5 10.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.737 -0.665 . . . . 0.09 110.522 175.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.584 ' CG ' HD13 ' A' ' 48' ' ' LEU . 43.8 mt-30 -52.59 -46.39 66.92 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.826 -1.079 . . . . 1.2 112.239 176.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 102' ' ' MET . 13.7 mm100 -64.14 -27.93 69.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.671 0.748 . . . . 2.37 110.287 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.726 HG13 ' O ' ' A' ' 103' ' ' THR . 7.2 mt -81.08 -41.05 18.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 114.737 -1.119 . . . . 0.15 110.798 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.657 HD12 HD11 ' A' ' 48' ' ' LEU . 6.3 mt -67.29 -38.63 81.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.354 -0.385 . . . . 0.19 111.84 -178.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.2 p -59.97 -24.92 64.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.014 0.435 . . . . 1.14 111.202 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 -62.25 -52.31 64.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.608 0.718 . . . . 1.64 109.55 172.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.537 ' CG ' ' HA ' ' A' ' 43' ' ' SER . 21.5 m-85 -85.7 18.37 2.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.02 -0.991 . . . . 0.65 110.472 177.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? . . . . . 0 C--N 1.318 -0.766 0 N-CA-C 107.842 -1.17 . . . . 0.76 107.842 171.831 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.574 ' CD2' HG21 ' A' ' 103' ' ' THR . 56.2 m80 . . . . . 0 CA--C 1.511 -0.528 0 N-CA-C 109.624 -0.51 . . . . 0.75 109.624 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.9 p -157.71 168.54 26.93 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.604 -0.839 . . . . 1.09 112.785 -176.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.448 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 173.54 -163.43 34.74 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 110.116 -1.194 . . . . 0.16 110.116 -178.339 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -100.29 135.66 41.38 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 117.513 0.657 . . . . 0.16 110.167 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -145.43 152.27 39.56 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.42 -0.355 . . . . 0.11 110.859 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.41 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 79.0 mt -111.7 122.21 65.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.446 -0.343 . . . . 0.33 110.465 178.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.505 ' O ' HG13 ' A' ' 12' ' ' VAL . 32.4 t80 -126.17 132.6 51.78 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.218 -0.66 . . . . 0.36 109.218 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 58.98 28.16 17.3 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.037 0.535 . . . . 0.8 110.328 -176.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt 69.34 0.77 3.01 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.015 0.746 . . . . 2.11 113.015 178.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -91.45 121.69 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 108.047 -1.094 . . . . 0.22 108.047 167.077 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.7 m -75.61 145.22 41.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.095 -0.502 . . . . 1.07 110.21 -177.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.46 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.33 -156.81 8.46 Favored Glycine 0 N--CA 1.436 -1.363 0 C-N-CA 120.078 -1.058 . . . . 0.11 113.482 -177.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 15.8 mm -125.44 132.31 71.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 C-N-CA 123.217 0.607 . . . . 0.13 109.429 -177.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.572 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.73 135.96 38.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.704 -0.48 . . . . 0.13 109.704 -177.483 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.87 130.87 32.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.808 0.337 . . . . 0.1 111.264 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.513 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 52.8 mt -86.16 138.12 19.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 109.685 -0.487 . . . . 0.27 109.685 177.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -111.22 103.16 11.55 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.137 -0.483 . . . . 1.24 111.091 -174.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 31.1 mt-10 -115.94 170.36 8.54 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.163 -0.68 . . . . 1.2 109.163 175.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 26.5 t70 77.26 -3.28 2.49 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.37 1.081 . . . . 0.58 109.583 -178.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 23' ' ' SER . 32.8 m -103.0 -173.92 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.046 0 CA-C-N 113.885 -1.507 . . . . 0.25 109.798 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.625 ' O ' HG23 ' A' ' 22' ' ' VAL . 53.6 m -73.01 166.52 42.72 Favored Pre-proline 0 C--N 1.315 -0.896 0 N-CA-C 105.211 -2.144 . . . . 1.13 105.211 173.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -41.34 128.52 3.26 Favored 'Trans proline' 0 C--N 1.355 0.902 0 CA-C-N 121.037 1.406 . . . . 0.16 112.738 -141.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.498 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -50.21 142.18 10.26 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 114.105 -1.407 . . . . 0.1 112.593 -165.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -127.74 169.4 13.89 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 114.447 -1.251 . . . . 0.32 111.985 -168.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -120.46 107.25 12.66 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 107.939 -1.134 . . . . 0.09 107.939 174.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.8 m -101.42 108.53 20.16 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 116.427 -0.351 . . . . 0.17 111.193 -175.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.494 ' HH2' ' HG ' ' A' ' 31' ' ' SER . 87.8 t90 -85.3 131.13 34.46 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.853 -0.795 . . . . 0.14 108.853 170.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.545 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 89.1 mtt180 -122.26 151.12 41.41 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.628 -0.878 . . . . 1.91 108.628 172.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.672 ' OG ' ' HB3' ' A' ' 36' ' ' LYS . 2.8 m -61.99 172.49 1.36 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.16 -0.311 . . . . 0.6 110.16 173.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.46 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.1 p -60.02 -36.13 76.58 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.218 -0.593 . . . . 0.26 110.62 178.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -86.17 -14.68 43.33 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.397 -0.594 . . . . 2.12 109.397 175.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.545 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 76.99 19.51 77.35 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.147 -0.933 . . . . 0.23 112.513 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -84.37 -35.43 23.19 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.533 -0.914 . . . . 1.73 108.533 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.672 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 43.7 tttp -90.68 141.09 29.15 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.18 -1.373 . . . . 1.3 108.59 172.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.491 HG23 ' HG2' ' A' ' 30' ' ' ARG . 9.5 p -150.28 138.56 14.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 C-N-CA 120.834 -0.346 . . . . 0.17 111.066 -176.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -145.07 125.02 13.48 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.973 -0.38 . . . . 0.41 109.973 175.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 31.7 m -110.67 137.11 48.76 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.104 0.409 . . . . 0.15 112.104 -174.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.37 129.53 56.58 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 N-CA-C 108.117 -1.068 . . . . 0.12 108.117 168.636 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.9 t -93.15 121.66 44.02 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 O-C-N 121.23 -0.919 . . . . 0.11 108.926 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.592 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -68.71 -18.56 64.27 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.104 0.779 . . . . 0.08 113.104 -169.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.7 p -72.0 -11.93 61.0 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.066 -0.654 . . . . 0.87 109.75 175.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.2 p -111.31 13.07 21.66 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.345 -0.843 . . . . 0.15 109.624 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.553 HG21 HD13 ' A' ' 62' ' ' LEU . 26.8 mm -113.75 138.04 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-N 115.712 -0.676 . . . . 0.12 109.25 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -101.75 -42.56 6.13 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.094 -0.503 . . . . 0.52 110.456 -177.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.4 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 15.0 mtmm -142.17 172.7 12.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.306 -0.407 . . . . 1.41 111.012 -176.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.844 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -151.01 149.04 29.09 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.591 -0.892 . . . . 0.73 108.591 179.739 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.463 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 16.5 mm-40 -138.64 127.76 24.09 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 110.453 -0.203 . . . . 1.94 110.453 -175.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.587 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -122.01 134.85 54.8 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.452 -0.78 . . . . 0.22 110.968 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.458 ' HB ' ' OG ' ' A' ' 55' ' ' SER . 69.1 p -63.37 115.39 17.71 Favored Pre-proline 0 C--O 1.234 0.247 0 CA-C-N 115.913 -0.585 . . . . 0.26 110.409 -175.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 2.2 Cg_endo -54.98 158.95 10.31 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.953 2.436 . . . . 0.38 112.046 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.94 -11.76 49.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.273 -0.421 . . . . 0.66 111.382 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.0 t -109.4 25.9 11.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.24 0.543 . . . . 1.5 110.358 176.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.458 ' OG ' ' HB ' ' A' ' 51' ' ' THR . 83.9 p -99.98 158.83 15.54 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.746 -0.464 . . . . 0.85 109.746 176.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -82.84 12.68 4.55 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 121.298 0.571 . . . . 1.77 110.516 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.523 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 42.9 mmtm -130.6 162.97 28.16 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.539 -0.755 . . . . 1.63 111.271 -171.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.438 ' O ' ' HG3' ' A' ' 59' ' ' MET . 3.5 mtp -136.9 97.95 3.65 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.997 -1.001 . . . . 1.11 108.826 167.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.523 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -156.81 155.13 31.01 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.556 -0.747 . . . . 0.22 111.41 -171.557 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.596 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -131.94 119.03 20.57 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.383 -0.969 . . . . 0.1 108.383 176.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.612 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 6.9 mtp180 -102.82 146.04 28.87 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 121.423 0.63 . . . . 2.99 111.325 -179.011 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.941 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -125.63 104.72 8.53 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 114.524 -1.216 . . . . 0.13 108.787 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.532 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.0 mp -85.66 102.3 11.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.724 0.297 . . . . 0.29 110.315 -172.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.434 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -63.94 152.96 48.18 Favored Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 115.854 -0.612 . . . . 0.54 112.455 178.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 76.8 mttt . . . . . 0 C--N 1.317 -0.804 0 CA-C-O 121.436 0.636 . . . . 0.55 112.509 -175.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 34.4 m-20 . . . . . 0 C--O 1.216 -0.671 0 N-CA-C 108.359 -0.978 . . . . 3.23 108.359 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 82' ' ' PRO . 46.2 mt-10 -64.86 -1.18 1.82 Allowed 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 112.651 0.611 . . . . 2.39 112.651 -171.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.3 p -72.75 -9.18 58.35 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.401 0.62 . . . . 2.96 109.94 168.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.603 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 11.6 ptmm? -80.03 41.79 0.53 Allowed 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.261 -0.882 . . . . 2.49 111.051 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.418 ' HE2' ' OE1' ' A' ' 79' ' ' GLU . 18.9 mttp -43.41 117.39 1.11 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.562 -0.744 . . . . 3.4 111.411 -175.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.566 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 25.7 ttt180 -101.47 158.87 15.75 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.15 -0.932 . . . . 3.8 109.118 -175.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 94.1 mttt -131.54 146.67 52.33 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.361 -0.607 . . . . 4.29 109.361 171.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.466 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER -76.62 -174.33 2.92 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.194 -0.457 . . . . 4.41 110.229 -178.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -56.65 -32.94 65.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 111.801 0.297 . . . . 5.34 111.801 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.466 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 21.5 mt-10 -81.02 -46.52 14.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.833 0.349 . . . . 5.38 110.823 -178.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.01 13.66 1.17 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.669 -0.776 . . . . 4.37 112.494 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 37.8 m-80 -71.1 129.01 37.85 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.402 -0.592 . . . . 4.51 109.402 177.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.418 ' OE1' ' HE2' ' A' ' 71' ' ' LYS . 35.4 tt0 -70.05 101.85 1.91 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.099 0.476 . . . . 4.28 110.083 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.566 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 10.1 m -113.88 98.76 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 CA-C-O 121.818 0.818 . . . . 3.1 109.017 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.448 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.5 OUTLIER -87.74 112.64 50.09 Favored Pre-proline 0 C--N 1.311 -1.104 0 CA-C-N 115.762 -0.653 . . . . 2.5 110.035 -177.846 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.481 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 31.7 Cg_exo . . . . . 0 CA--C 1.511 -0.628 0 C-N-CA 123.152 2.568 . . . . 1.87 112.636 -176.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.596 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 75.2 m-70 . . . . . 0 C--O 1.215 -0.743 0 N-CA-C 107.022 -1.473 . . . . 0.72 107.022 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.612 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 25.2 ttm -139.99 124.96 18.51 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 119.056 0.844 . . . . 0.27 111.047 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.425 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.6 m-85 -113.95 128.72 56.52 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.166 -0.925 . . . . 0.27 109.443 178.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.449 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.6 OUTLIER -80.99 151.59 28.38 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.92 -0.4 . . . . 1.26 109.92 176.771 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.402 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 24.3 m-85 -132.75 173.37 11.43 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.057 0.455 . . . . 0.32 110.809 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -124.9 -6.29 7.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.5 -0.773 . . . . 2.38 109.424 172.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.412 ' HB2' HG23 ' A' ' 96' ' ' VAL . 49.2 m-80 -136.55 120.4 17.45 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.953 -0.567 . . . . 1.1 110.882 -175.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.486 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.0 mmm180 -64.0 -35.58 81.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.344 -0.844 . . . . 3.09 111.872 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.2 m -63.17 -36.62 84.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.448 -0.342 . . . . 0.35 110.883 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.591 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.5 t -67.1 -57.19 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 CA-C-N 116.47 -0.332 . . . . 0.23 110.203 178.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.596 ' HA ' HD12 ' A' ' 60' ' ' LEU . 12.9 ptp -56.59 -37.84 71.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.17 111.363 -175.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.55 -43.18 85.78 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.602 -0.439 . . . . 0.34 110.765 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.415 ' HA ' ' HE2' ' A' ' 102' ' ' MET . 8.1 m-80 -69.5 -41.49 76.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.447 -0.342 . . . . 1.36 111.471 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.638 HG22 HD11 ' A' ' 104' ' ' LEU . 30.1 mm -62.45 -57.41 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 108.685 -0.857 . . . . 0.12 108.685 176.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.823 ' HA ' HD12 ' A' ' 104' ' ' LEU . 23.4 ttpp -50.12 -49.56 51.4 Favored 'General case' 0 C--O 1.218 -0.583 0 O-C-N 123.902 0.751 . . . . 0.79 110.164 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.699 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 37.4 ttp -48.76 -59.8 3.25 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 123.961 0.788 . . . . 0.28 111.391 177.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.782 ' O ' HG13 ' A' ' 107' ' ' ILE . 36.0 m -57.76 -50.46 73.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.304 -0.407 . . . . 0.18 110.335 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.941 HD13 HD21 ' A' ' 62' ' ' LEU . 35.3 mt -46.81 -55.77 7.38 Favored 'General case' 0 C--O 1.221 -0.404 0 O-C-N 123.744 0.652 . . . . 0.09 110.278 174.052 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.827 ' HG2' HD13 ' A' ' 48' ' ' LEU . 51.2 mt-30 -54.52 -44.95 73.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.913 -1.04 . . . . 1.2 112.134 177.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.699 ' HG3' ' O ' ' A' ' 102' ' ' MET . 22.6 mt-30 -61.82 -31.51 71.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.847 0.832 . . . . 2.37 108.956 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.782 HG13 ' O ' ' A' ' 103' ' ' THR . 8.6 mt -80.99 -43.75 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 114.584 -1.189 . . . . 0.15 111.163 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.844 HD12 HD11 ' A' ' 48' ' ' LEU . 9.0 mt -63.95 -37.52 80.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.164 -0.471 . . . . 0.19 111.638 -177.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.6 t -55.4 -30.92 61.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.283 -0.417 . . . . 1.14 110.782 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -62.47 -41.61 98.89 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.264 0.554 . . . . 1.64 109.732 176.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -97.73 18.73 15.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.701 -0.682 . . . . 0.65 109.963 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.68 0 N-CA-C 107.926 -1.138 . . . . 0.76 107.926 176.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.402 ' CD2' HG21 ' A' ' 103' ' ' THR . 76.0 m80 . . . . . 0 N--CA 1.473 0.691 0 N-CA-C 112.664 0.616 . . . . 0.75 112.664 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.4 p -149.03 171.89 15.64 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.214 -0.594 . . . . 1.09 112.592 -170.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.51 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 169.77 -160.31 33.32 Favored Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 115.041 -0.981 . . . . 0.16 110.744 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.36 132.01 52.9 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 117.423 0.612 . . . . 0.16 110.315 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.538 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -143.82 147.43 34.1 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.566 -0.288 . . . . 0.11 111.709 -176.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.793 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 64.6 mt -104.44 133.59 48.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.874 0.369 . . . . 0.33 110.178 175.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -132.85 129.14 38.07 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 108.534 -0.913 . . . . 0.36 108.534 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 56.75 34.27 24.35 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.559 0.344 . . . . 0.8 110.977 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm 69.72 -3.98 1.54 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.27 0.841 . . . . 2.11 113.27 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.2 p -92.2 118.03 36.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 108.664 -0.865 . . . . 0.22 108.664 170.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -75.06 145.79 42.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.02 -0.536 . . . . 1.07 110.337 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -160.71 -160.99 11.07 Favored Glycine 0 N--CA 1.439 -1.161 0 C-N-CA 120.149 -1.024 . . . . 0.11 113.244 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -124.66 132.38 71.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 109.281 -0.637 . . . . 0.13 109.281 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.574 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.49 135.39 41.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 110.221 -0.288 . . . . 0.13 110.221 -175.327 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.6 130.42 27.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.625 -0.261 . . . . 0.1 111.499 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.465 HD13 ' HB ' ' A' ' 103' ' ' THR . 43.3 mt -85.55 137.48 20.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.384 0.611 . . . . 0.27 110.449 176.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -106.76 106.23 16.65 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.999 -1.0 . . . . 1.24 110.791 -176.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -118.86 169.05 10.2 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.502 -0.555 . . . . 1.2 109.502 175.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.7 t70 76.25 -0.73 3.05 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 122.381 1.086 . . . . 0.58 109.601 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 23' ' ' SER . 33.9 m -103.55 -171.65 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 113.7 -1.591 . . . . 0.25 109.869 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.63 ' O ' HG23 ' A' ' 22' ' ' VAL . 54.9 p -71.94 168.34 23.61 Favored Pre-proline 0 C--N 1.318 -0.775 0 N-CA-C 105.259 -2.126 . . . . 1.13 105.259 175.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -42.73 128.29 4.94 Favored 'Trans proline' 0 C--N 1.355 0.92 0 CA-C-N 121.524 1.58 . . . . 0.16 112.059 -145.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.465 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.85 142.86 18.05 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-N 114.093 -1.412 . . . . 0.1 112.245 -162.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -127.47 168.48 14.84 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 114.534 -1.212 . . . . 0.32 112.133 -168.195 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.807 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -118.16 106.77 13.18 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.649 -1.241 . . . . 0.09 107.649 173.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.492 HG23 ' OG1' ' A' ' 39' ' ' THR . 6.9 m -102.96 107.2 17.92 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 120.998 0.428 . . . . 0.17 111.23 -176.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -85.02 131.39 34.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.716 -0.846 . . . . 0.14 108.716 171.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.47 ' HG2' HG23 ' A' ' 37' ' ' VAL . 60.8 mtt85 -126.43 158.83 34.98 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.918 -0.771 . . . . 1.91 108.918 174.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.0 p -68.15 176.33 2.76 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.669 -0.493 . . . . 0.6 109.669 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.5 p -58.78 -35.96 73.65 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 120.524 -0.471 . . . . 0.26 111.538 -179.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -93.77 -28.74 15.74 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.301 -0.629 . . . . 2.12 109.301 172.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.439 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 101.2 17.41 22.52 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.313 -0.858 . . . . 0.23 113.198 174.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -66.12 -48.26 71.44 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.865 -0.42 . . . . 1.73 109.865 173.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.0 tttt -82.89 138.05 34.02 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.925 -0.768 . . . . 1.3 108.925 174.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.47 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.5 p -149.25 135.64 12.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.009 0.433 . . . . 0.17 111.157 -177.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -144.58 128.92 17.86 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.881 -0.415 . . . . 0.41 109.881 178.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.492 ' OG1' HG23 ' A' ' 28' ' ' THR . 47.0 m -117.86 137.96 52.43 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.343 0.497 . . . . 0.15 112.343 -172.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.807 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.68 130.7 55.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 N-CA-C 108.329 -0.989 . . . . 0.12 108.329 169.242 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.41 ' O ' HG12 ' A' ' 45' ' ' ILE . 94.5 t -93.13 120.43 42.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 O-C-N 121.305 -0.872 . . . . 0.11 108.702 172.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.627 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -67.83 -18.86 64.97 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.875 0.695 . . . . 0.08 112.875 -170.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.426 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 15.5 t -69.78 -13.57 62.35 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.327 -0.549 . . . . 0.87 109.84 174.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.2 p -108.99 6.81 25.5 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.934 -0.575 . . . . 0.15 109.844 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.6 HG21 ' CD1' ' A' ' 62' ' ' LEU . 32.2 mm -109.27 138.37 36.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.671 -0.695 . . . . 0.12 109.792 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -102.58 -45.91 4.9 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.805 -0.634 . . . . 0.52 110.631 -178.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.538 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 23.5 mtpp -133.21 173.77 11.09 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.368 0.604 . . . . 1.41 111.861 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.823 HD11 HD12 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -153.38 142.09 20.98 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.809 -1.087 . . . . 0.73 108.657 178.009 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.49 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 15.1 mm-40 -136.53 127.16 27.06 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 110.348 -0.241 . . . . 1.94 110.348 -174.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.427 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -121.92 135.2 54.86 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 121.548 -0.72 . . . . 0.22 111.583 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.425 HG21 ' CB ' ' A' ' 57' ' ' LYS . 80.0 p -64.9 119.03 54.71 Favored Pre-proline 0 N--CA 1.467 0.403 0 CA-C-N 115.909 -0.587 . . . . 0.26 110.949 -176.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.463 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 23.7 Cg_exo -55.56 159.36 11.15 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.859 2.372 . . . . 0.38 112.006 178.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.67 -14.89 63.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.91 -0.586 . . . . 0.66 110.721 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.58 -7.68 43.38 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.474 -0.785 . . . . 1.5 110.386 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.48 ' C ' ' H ' ' A' ' 57' ' ' LYS . 42.4 m -83.88 147.35 27.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.938 -0.574 . . . . 0.85 111.805 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -70.46 11.94 0.3 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.479 -0.782 . . . . 1.77 111.851 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.554 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 25.8 mmtp -127.03 157.96 38.21 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.58 -0.737 . . . . 1.63 111.41 -171.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.539 ' O ' ' HG3' ' A' ' 59' ' ' MET . 70.8 mmm -130.94 96.36 4.04 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.017 -1.105 . . . . 1.11 108.017 165.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.554 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -156.15 152.51 28.0 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.52 0.676 . . . . 0.22 111.891 -172.181 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.5 tt -131.67 119.62 21.63 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.665 -1.152 . . . . 0.1 108.453 178.094 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.49 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 7.6 mtp180 -102.24 144.24 31.01 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 121.122 0.487 . . . . 2.99 111.154 -178.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.937 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -122.88 111.81 17.1 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.167 -0.924 . . . . 0.13 109.228 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.538 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 2.8 mp -87.98 107.76 17.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 122.462 0.305 . . . . 0.29 110.93 -171.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.96 143.75 35.37 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.216 -0.516 . . . . 0.54 112.241 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.434 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.1 mttt . . . . . 0 C--N 1.321 -0.658 0 N-CA-C 113.221 0.823 . . . . 0.55 113.221 -174.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.607 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 24.1 m-20 . . . . . 0 N--CA 1.447 -0.62 0 N-CA-C 108.103 -1.073 . . . . 3.23 108.103 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.25 -3.8 1.49 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.22 0.822 . . . . 2.39 113.22 -169.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.1 p -71.46 -12.2 61.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.134 0.492 . . . . 2.96 109.959 171.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 21.1 ptmt -76.4 42.91 0.29 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.693 0.797 . . . . 2.49 110.772 176.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -45.33 115.67 0.97 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.689 -0.687 . . . . 3.4 110.827 -174.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.594 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 79.6 ttt180 -94.65 163.55 13.33 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.605 -0.725 . . . . 3.8 109.39 -172.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 93.7 mttt -130.74 146.19 52.14 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.882 -0.414 . . . . 4.29 109.882 173.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -88.82 -165.66 1.39 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.477 -0.783 . . . . 4.41 110.781 -173.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -66.13 -16.56 64.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.337 0.495 . . . . 5.34 112.337 -176.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.575 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 22.6 mt-10 -107.02 -8.0 16.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.866 0.365 . . . . 5.38 111.088 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.72 14.32 47.2 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.529 -0.844 . . . . 4.37 112.21 -178.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.575 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 50.0 m-80 -71.28 138.9 49.74 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.899 -0.778 . . . . 4.51 108.899 176.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -76.0 100.55 4.93 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.123 0.487 . . . . 4.28 109.811 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.594 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 11.0 m -114.24 106.27 20.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.292 0.567 . . . . 3.1 109.797 -177.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.476 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 t -80.19 128.13 74.3 Favored Pre-proline 0 C--N 1.316 -0.871 0 C-N-CA 120.307 -0.557 . . . . 2.5 110.497 -175.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 25.4 Cg_exo . . . . . 0 CA--C 1.513 -0.563 0 C-N-CA 123.254 2.636 . . . . 1.87 112.099 -178.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 87.3 m-70 . . . . . 0 C--O 1.223 -0.32 0 N-CA-C 107.964 -1.124 . . . . 0.72 107.964 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.436 ' HG3' ' HG2' ' A' ' 61' ' ' ARG . 28.0 ttm -141.22 135.47 30.76 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 118.627 0.649 . . . . 0.27 110.611 174.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.539 ' O ' ' HA ' ' A' ' 59' ' ' MET . 11.3 m-85 -126.34 134.74 51.0 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.044 -0.526 . . . . 0.27 109.724 174.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.793 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -80.83 158.47 25.38 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.32 -0.622 . . . . 1.26 109.32 176.65 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.506 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.7 m-85 -140.16 171.25 14.43 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.896 0.379 . . . . 0.32 110.99 -178.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -121.94 -15.04 7.93 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.12 -0.491 . . . . 2.38 110.288 175.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.444 ' HB2' HG23 ' A' ' 96' ' ' VAL . 41.6 m-80 -135.86 122.16 20.48 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.238 0.542 . . . . 1.1 110.68 -177.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.544 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.8 mmm180 -59.86 -34.8 73.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.098 -0.956 . . . . 3.09 112.276 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.443 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 19.2 m -61.96 -32.67 73.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.854 0.359 . . . . 0.35 110.567 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.635 ' O ' HG12 ' A' ' 100' ' ' ILE . 18.8 t -69.92 -58.8 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 CA-C-N 116.249 -0.432 . . . . 0.23 110.363 179.047 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.575 ' HA ' HD12 ' A' ' 60' ' ' LEU . 11.6 ptp -55.84 -37.76 69.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.088 -0.505 . . . . 0.17 111.261 -176.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.443 ' N ' ' HG3' ' A' ' 97' ' ' MET . 37.4 t70 -64.65 -48.23 75.57 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.628 -0.429 . . . . 0.34 110.096 176.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 95' ' ' THR . 7.9 t-20 -63.42 -41.68 98.7 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.608 0.763 . . . . 1.36 111.409 -179.274 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.656 HG22 HD11 ' A' ' 104' ' ' LEU . 30.9 mm -63.97 -58.51 7.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 109.278 -0.638 . . . . 0.12 109.278 178.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.851 ' HA ' HD12 ' A' ' 104' ' ' LEU . 23.5 ttpp -51.44 -47.86 62.92 Favored 'General case' 0 C--O 1.215 -0.729 0 O-C-N 123.785 0.678 . . . . 0.79 110.02 177.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.501 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.9 ttp -48.65 -54.38 14.93 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.238 -0.892 . . . . 0.28 111.255 176.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.734 ' O ' HG13 ' A' ' 107' ' ' ILE . 28.1 m -60.69 -55.2 36.11 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.835 -0.621 . . . . 0.18 110.205 178.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.937 HD13 HD21 ' A' ' 62' ' ' LEU . 30.7 mt -45.8 -55.03 7.09 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.391 -0.822 . . . . 0.09 110.613 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.761 ' HG2' HD13 ' A' ' 48' ' ' LEU . 49.8 mt-30 -53.36 -45.02 69.01 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.519 -1.219 . . . . 1.2 112.454 178.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.501 ' HG2' ' O ' ' A' ' 102' ' ' MET . 75.5 mm-40 -64.87 -34.96 79.63 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.674 0.75 . . . . 2.37 109.85 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.734 HG13 ' O ' ' A' ' 103' ' ' THR . 8.9 mt -71.45 -45.49 68.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.604 -1.18 . . . . 0.15 110.879 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.823 HD12 HD11 ' A' ' 48' ' ' LEU . 10.1 mt -63.09 -40.48 89.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.135 -0.484 . . . . 0.19 111.331 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 t -58.18 -26.5 62.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.196 -0.456 . . . . 1.14 111.068 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -63.41 -49.11 75.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.062 0.458 . . . . 1.64 109.883 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.426 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 34.2 m-85 -79.75 -12.16 59.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.619 -0.718 . . . . 0.65 110.013 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.321 -0.632 0 CA-C-N 115.102 -0.954 . . . . 0.76 108.819 174.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.491 ' HB3' ' HB ' ' A' ' 18' ' ' ILE . 75.6 m80 . . . . . 0 CA--C 1.515 -0.393 0 N-CA-C 110.448 -0.205 . . . . 0.75 110.448 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.8 t -152.17 155.02 36.99 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.891 -0.724 . . . . 1.09 112.626 -168.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.565 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . -174.44 -164.31 29.15 Favored Glycine 0 N--CA 1.437 -1.245 0 CA-C-N 114.341 -1.3 . . . . 0.16 110.554 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.98 135.05 39.54 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 117.558 0.679 . . . . 0.16 110.906 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -148.76 153.26 37.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.389 -0.369 . . . . 0.11 111.647 -178.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.766 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.9 mt -112.25 128.29 68.96 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 CA-C-O 120.686 0.279 . . . . 0.33 110.461 177.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -126.97 133.53 50.56 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 108.897 -0.779 . . . . 0.36 108.897 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 58.85 27.77 16.58 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.758 0.423 . . . . 0.8 110.857 -178.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt 70.5 0.06 3.1 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.218 0.607 . . . . 2.11 112.555 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.3 p -92.7 122.46 44.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 108.545 -0.909 . . . . 0.22 108.545 167.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.9 p -81.71 145.98 30.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.224 -0.444 . . . . 1.07 111.072 -173.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.451 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -162.68 -154.92 7.8 Favored Glycine 0 N--CA 1.439 -1.103 0 C-N-CA 120.375 -0.917 . . . . 0.11 113.461 -177.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.9 mm -126.71 130.5 71.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 109.334 -0.617 . . . . 0.13 109.334 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.575 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -100.8 137.07 29.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 110.101 -0.333 . . . . 0.13 110.101 -175.857 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.83 129.8 28.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.701 0.286 . . . . 0.1 111.573 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.491 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 41.3 mt -85.5 139.02 18.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.237 0.542 . . . . 0.27 109.81 174.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.438 ' O ' ' HA ' ' A' ' 25' ' ' ALA . 17.4 t30 -110.33 103.26 11.9 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.973 -1.012 . . . . 1.24 111.301 -174.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 31.1 mt-10 -114.61 169.76 8.82 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.863 -0.791 . . . . 1.2 108.863 174.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.457 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 38.0 t70 79.49 -5.59 1.91 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 122.446 1.117 . . . . 0.58 109.776 -176.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 23' ' ' SER . 22.8 m -103.23 -172.73 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.05 0 CA-C-N 113.767 -1.561 . . . . 0.25 109.406 178.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.644 ' O ' HG23 ' A' ' 22' ' ' VAL . 59.3 p -72.41 167.92 28.31 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 105.199 -2.149 . . . . 1.13 105.199 175.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -41.66 127.04 3.35 Favored 'Trans proline' 0 C--N 1.355 0.892 0 CA-C-N 121.317 1.506 . . . . 0.16 112.729 -143.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.438 ' HA ' ' O ' ' A' ' 19' ' ' ASN . . . -43.38 136.8 2.98 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 113.841 -1.527 . . . . 0.1 112.895 -168.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.68 169.07 12.33 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 114.092 -1.413 . . . . 0.32 111.679 -169.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.668 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -119.57 105.38 11.16 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 107.807 -1.183 . . . . 0.09 107.807 174.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.7 m -104.58 106.89 17.56 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-O 121.155 0.502 . . . . 0.17 111.245 -176.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.41 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 79.9 t90 -84.63 128.61 34.69 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.965 -0.754 . . . . 0.14 108.965 172.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.474 ' HG2' HG23 ' A' ' 37' ' ' VAL . 96.1 mtt180 -120.48 158.11 27.94 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.455 -0.943 . . . . 1.91 108.455 172.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 p -70.18 176.09 4.12 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.275 -0.639 . . . . 0.6 109.275 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.451 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 4.2 p -57.32 -36.25 70.88 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.524 . . . . 0.26 111.004 -179.022 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -91.82 -30.92 15.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.569 0.699 . . . . 2.12 109.759 172.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.421 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 99.5 15.5 32.0 Favored Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.152 -0.931 . . . . 0.23 112.769 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.92 -42.06 95.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.334 -0.617 . . . . 1.73 109.334 175.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -91.27 139.41 30.76 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.815 -0.809 . . . . 1.3 108.815 173.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.474 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.9 p -149.61 137.72 14.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 120.79 0.328 . . . . 0.17 110.967 -179.071 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -144.51 129.04 18.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.634 -0.257 . . . . 0.41 110.351 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 53.3 m -112.52 143.59 43.42 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.216 0.451 . . . . 0.15 112.216 -174.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.668 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -113.6 129.89 68.62 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.722 0 N-CA-C 107.923 -1.14 . . . . 0.12 107.923 167.847 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 67.2 t -92.32 121.04 42.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 O-C-N 121.024 -1.047 . . . . 0.11 108.914 173.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.619 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -68.91 -18.38 64.1 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 113.011 0.745 . . . . 0.08 113.011 -169.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 p -69.02 -16.76 63.79 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.574 0.702 . . . . 0.87 109.382 175.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.415 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 4.7 p -109.06 16.62 22.43 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.977 -1.011 . . . . 0.15 110.088 -178.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.489 HG21 HD13 ' A' ' 62' ' ' LEU . 31.2 mm -112.25 138.38 41.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.759 -0.46 . . . . 0.12 109.759 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -102.07 -40.22 6.94 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.013 -0.54 . . . . 0.52 110.657 -176.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.459 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 12.4 mtmm -144.96 174.46 11.0 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.872 0.367 . . . . 1.41 111.26 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.627 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -151.34 133.63 15.32 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.632 -0.877 . . . . 0.73 108.632 177.079 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.718 ' HG3' HD11 ' A' ' 63' ' ' ILE . 9.2 mt-30 -130.01 127.2 39.5 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 110.285 -0.265 . . . . 1.94 110.285 -176.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -118.06 141.47 48.44 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 121.914 -0.492 . . . . 0.22 111.039 178.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.444 HG21 ' HB3' ' A' ' 57' ' ' LYS . 53.0 p -62.29 121.24 65.24 Favored Pre-proline 0 C--N 1.332 -0.175 0 CA-C-N 115.912 -0.585 . . . . 0.26 110.633 -178.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 55' ' ' SER . 24.0 Cg_exo -53.96 163.58 3.04 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.66 2.24 . . . . 0.38 112.465 178.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.73 79.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.146 -0.479 . . . . 0.66 110.598 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.0 m -76.11 -13.73 60.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.569 -0.741 . . . . 1.5 111.035 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 52' ' ' PRO . 46.1 m -75.1 135.3 41.18 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 121.697 0.761 . . . . 0.85 111.391 179.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -59.46 -26.77 65.51 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.009 -1.45 . . . . 1.77 110.756 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.444 ' HB3' HG21 ' A' ' 51' ' ' THR . 37.0 mmtt -82.74 146.74 28.84 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 114.399 -1.273 . . . . 1.63 111.493 -177.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.569 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.4 OUTLIER -123.07 96.63 5.09 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.032 -0.986 . . . . 1.11 108.564 170.021 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.569 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -156.31 152.31 27.5 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 121.585 0.707 . . . . 0.22 112.069 -173.543 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -129.83 118.89 22.47 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.553 -1.203 . . . . 0.1 108.143 177.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.415 ' HG2' ' HG3' ' A' ' 88' ' ' MET . 15.0 mtm180 -101.83 133.47 46.54 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.229 0.538 . . . . 2.99 110.886 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.944 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -111.84 107.26 16.24 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 115.099 -0.955 . . . . 0.13 109.205 176.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.718 HD11 ' HG3' ' A' ' 49' ' ' GLN . 1.4 mp -85.31 97.81 5.88 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 109.368 -0.604 . . . . 0.29 109.368 -172.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.463 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -76.31 134.48 15.72 Favored Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 115.941 -0.572 . . . . 0.54 112.46 -176.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.437 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 96.1 mttt . . . . . 0 C--N 1.321 -0.672 0 C-N-CA 123.162 0.585 . . . . 0.55 112.188 -176.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.75 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 18.7 t70 . . . . . 0 C--O 1.218 -0.583 0 N-CA-C 109.02 -0.733 . . . . 3.23 109.02 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.11 -2.3 5.41 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.013 0.745 . . . . 2.39 113.013 -169.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.16 -14.16 62.18 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.155 0.503 . . . . 2.96 110.059 170.105 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.75 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.1 ptpt -82.3 36.22 0.46 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.759 -0.655 . . . . 2.49 110.742 175.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.508 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 31.5 mmtm -44.97 116.1 1.02 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.624 -0.51 . . . . 3.4 109.624 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.618 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 60.4 ttt180 -96.87 164.49 12.53 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 108.755 -0.831 . . . . 3.8 108.755 -173.065 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 57.3 mttp -127.69 141.88 51.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.987 0.422 . . . . 4.29 110.023 171.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -82.69 -171.07 3.3 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.466 -0.788 . . . . 4.41 110.451 -176.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -61.27 -31.14 70.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 111.606 0.225 . . . . 5.34 111.606 -178.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.478 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 28.1 mt-10 -85.14 -18.81 33.04 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.079 -0.248 . . . . 5.38 111.332 -179.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 99.84 25.67 8.97 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.403 -0.903 . . . . 4.37 112.952 177.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.537 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 31.1 m-80 -90.47 144.69 25.56 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.233 -0.654 . . . . 4.51 109.233 176.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -69.86 91.45 0.65 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.883 0.373 . . . . 4.28 110.168 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.618 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.7 m -102.68 97.38 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 CA-C-O 122.014 0.911 . . . . 3.1 108.99 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.508 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 2.2 p -83.04 130.82 55.85 Favored Pre-proline 0 C--N 1.31 -1.15 0 CA-C-N 115.313 -0.858 . . . . 2.5 109.784 -178.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 47.8 Cg_exo . . . . . 0 CA--C 1.512 -0.599 0 C-N-CA 122.77 2.313 . . . . 1.87 111.993 -176.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 59.3 m-70 . . . . . 0 C--O 1.217 -0.619 0 N-CA-C 109.361 -0.607 . . . . 0.72 109.361 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.415 ' HG3' ' HG2' ' A' ' 61' ' ' ARG . 33.5 ttm -107.75 131.95 53.9 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.857 -0.737 . . . . 0.27 111.643 -176.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.7 m-85 -121.19 133.06 55.17 Favored 'General case' 0 C--O 1.215 -0.714 0 CA-C-N 115.5 -0.773 . . . . 0.27 109.869 177.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.766 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -80.05 159.23 26.24 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.231 -0.655 . . . . 1.26 109.231 176.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.566 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 18.7 m-85 -136.85 173.28 11.87 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.377 0.608 . . . . 0.32 112.021 -177.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -118.7 -21.46 7.87 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.043 -0.98 . . . . 2.38 110.208 178.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.482 ' HB2' HG23 ' A' ' 96' ' ' VAL . 53.4 m-80 -139.49 125.95 20.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.215 0.531 . . . . 1.1 110.74 -177.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.588 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.7 mmm180 -57.89 -30.88 66.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.192 -0.913 . . . . 3.09 111.997 177.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.7 m -64.27 -29.22 70.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.004 0.43 . . . . 0.35 110.554 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.732 ' HA ' ' ND2' ' A' ' 99' ' ' ASN . 5.2 t -85.15 -46.68 17.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 116.233 -0.44 . . . . 0.23 110.983 -177.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.62 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.2 ptp -61.72 -25.56 67.5 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.171 -0.612 . . . . 0.17 109.668 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 102' ' ' MET . 20.8 t70 -77.39 -38.59 49.57 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.137 -0.483 . . . . 0.34 110.642 172.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . 0.732 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 11.2 p30 -77.12 -33.58 56.79 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.705 0.261 . . . . 1.36 111.705 -175.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.651 HG22 HD11 ' A' ' 104' ' ' LEU . 39.2 mm -70.52 -56.02 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.529 0 N-CA-C 108.388 -0.967 . . . . 0.12 108.388 174.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.782 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.5 ttpt -48.89 -48.51 42.27 Favored 'General case' 0 C--O 1.218 -0.569 0 O-C-N 123.976 0.797 . . . . 0.79 109.752 176.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.764 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 40.7 ttp -48.44 -59.62 3.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.49 -0.777 . . . . 0.28 110.757 177.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.724 ' O ' HG13 ' A' ' 107' ' ' ILE . 60.0 m -57.77 -52.89 63.59 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.483 0.489 . . . . 0.18 110.71 -179.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.944 HD13 HD21 ' A' ' 62' ' ' LEU . 24.7 mt -47.28 -55.42 8.74 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.486 0.66 . . . . 0.09 110.527 175.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.547 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.3 mt-30 -51.69 -44.21 63.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.615 -1.175 . . . . 1.2 112.074 177.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.764 ' HG3' ' O ' ' A' ' 102' ' ' MET . 81.0 mt-30 -64.36 -35.47 80.97 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.725 0.774 . . . . 2.37 109.367 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.724 HG13 ' O ' ' A' ' 103' ' ' THR . 7.6 mt -75.95 -43.35 39.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 114.257 -1.338 . . . . 0.15 111.559 -176.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.585 HD12 HD11 ' A' ' 48' ' ' LEU . 7.2 mt -62.19 -43.15 97.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.25 0.463 . . . . 0.19 112.25 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.455 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 24.2 t -62.45 -20.17 64.26 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.69 0.281 . . . . 1.14 111.279 -176.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -65.21 -44.21 89.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.518 0.675 . . . . 1.64 109.307 173.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -87.54 -11.78 47.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.088 -0.96 . . . . 0.65 110.303 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.455 ' CB ' ' HA ' ' A' ' 109' ' ' SER . 1.8 tpmt? . . . . . 0 C--N 1.324 -0.511 0 N-CA-C 108.795 -0.817 . . . . 0.76 108.795 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.445 ' HB3' ' HB ' ' A' ' 18' ' ' ILE . 75.9 m80 . . . . . 0 N--CA 1.472 0.665 0 N-CA-C 112.498 0.555 . . . . 0.75 112.498 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.2 t -153.03 157.74 40.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.779 0.8 . . . . 1.09 112.717 -169.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.485 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -176.08 -170.04 38.33 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 114.125 -1.398 . . . . 0.16 109.83 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -93.19 135.17 34.64 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 117.71 0.755 . . . . 0.16 110.375 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.44 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -145.85 146.04 30.98 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.275 -0.42 . . . . 0.11 111.367 -177.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.455 HG12 ' HA ' ' A' ' 13' ' ' SER . 85.1 mt -107.37 120.65 59.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.304 -0.407 . . . . 0.33 110.287 177.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -123.36 137.47 54.82 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.801 -0.814 . . . . 0.36 108.801 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 57.27 25.66 11.39 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.659 0.384 . . . . 0.8 110.736 -176.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt 69.14 5.63 5.2 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.774 0.657 . . . . 2.11 112.774 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -97.48 129.9 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 108.884 -0.784 . . . . 0.22 108.884 166.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.455 ' HA ' HG12 ' A' ' 8' ' ' ILE . 15.0 m -78.53 146.07 34.52 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.02 0.438 . . . . 1.07 110.861 -175.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.406 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -164.19 -160.18 11.69 Favored Glycine 0 N--CA 1.437 -1.273 0 C-N-CA 120.133 -1.032 . . . . 0.11 113.052 -178.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.6 mm -126.05 133.11 69.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.148 -0.686 . . . . 0.13 109.148 -178.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.524 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.75 134.91 42.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 109.886 -0.413 . . . . 0.13 109.886 -176.862 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.95 130.61 31.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.568 0.223 . . . . 0.1 111.149 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.445 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 47.3 mt -86.6 139.4 17.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.311 0.577 . . . . 0.27 110.397 175.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -110.38 105.88 15.04 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 114.933 -1.03 . . . . 1.24 111.185 -176.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -116.9 170.41 8.64 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.146 -0.687 . . . . 1.2 109.146 174.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t70 77.78 -1.49 2.62 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 122.505 1.145 . . . . 0.58 109.399 -179.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' ' 23' ' ' SER . 31.6 m -103.48 -171.86 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 113.559 -1.655 . . . . 0.25 109.383 177.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.636 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.7 p -72.67 168.65 22.2 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 105.202 -2.148 . . . . 1.13 105.202 174.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.4 ' O ' HG13 ' A' ' 41' ' ' VAL . 72.9 Cg_exo -41.53 129.0 3.59 Favored 'Trans proline' 0 C--N 1.357 0.994 0 CA-C-N 121.501 1.572 . . . . 0.16 112.368 -145.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.469 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.56 142.17 18.64 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 114.164 -1.38 . . . . 0.1 112.381 -162.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.76 168.68 12.87 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.64 -1.163 . . . . 0.32 112.019 -170.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.754 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -119.79 108.97 15.04 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.798 -1.186 . . . . 0.09 107.798 175.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m -103.98 107.08 17.81 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 120.761 0.315 . . . . 0.17 111.1 -176.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.423 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 86.9 t90 -86.85 129.04 35.04 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.122 -0.696 . . . . 0.14 109.122 171.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.498 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 92.0 mtt180 -123.32 160.55 26.48 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.059 -0.719 . . . . 1.91 109.059 172.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.4 p -70.65 175.72 4.7 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.204 -0.665 . . . . 0.6 109.204 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.406 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.0 p -59.32 -35.88 74.62 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.221 -0.592 . . . . 0.26 111.104 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -88.39 -32.56 18.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.579 0.704 . . . . 2.12 109.396 171.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.498 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 98.56 14.79 36.69 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 114.957 -1.019 . . . . 0.23 113.339 173.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -67.47 -40.96 85.31 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.186 0.517 . . . . 1.73 109.776 174.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.2 135.58 33.52 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.577 -0.897 . . . . 1.3 108.577 174.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 12.0 p -149.46 140.26 16.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 C-N-CA 120.846 -0.342 . . . . 0.17 111.461 -177.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -144.32 125.4 14.51 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.832 -0.432 . . . . 0.41 109.832 175.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 41.1 m -109.26 137.63 46.84 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.752 0.279 . . . . 0.15 111.752 -175.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.754 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -107.98 128.84 63.02 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 108.329 -0.989 . . . . 0.12 108.329 169.583 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.409 ' O ' HG12 ' A' ' 45' ' ' ILE . 79.5 t -92.84 120.02 41.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 O-C-N 121.234 -0.916 . . . . 0.11 108.781 173.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.524 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.08 -19.59 64.07 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.077 0.769 . . . . 0.08 113.077 -169.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.6 p -69.46 -14.87 63.12 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 119.821 -0.752 . . . . 0.87 109.553 175.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.6 p -109.93 11.34 24.16 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.477 -0.783 . . . . 0.15 109.921 -179.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.597 HG21 ' CD1' ' A' ' 62' ' ' LEU . 20.5 mm -111.84 139.88 34.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.718 -0.674 . . . . 0.12 109.263 178.028 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -108.44 -40.73 5.04 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.396 -0.365 . . . . 0.52 110.914 -176.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.535 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 34.6 mtpt -132.61 167.83 19.34 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.709 0.766 . . . . 1.41 111.402 -178.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.594 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -150.77 132.69 15.12 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.432 -1.258 . . . . 0.73 107.862 174.811 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.49 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -133.06 114.76 14.3 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.329 -0.249 . . . . 1.94 110.329 -172.413 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.448 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -110.09 145.16 37.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.827 0.346 . . . . 0.22 110.981 -178.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 57' ' ' LYS . 76.4 p -67.54 118.42 56.91 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.765 -0.652 . . . . 0.26 110.781 -177.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.542 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 9.6 Cg_exo -59.82 163.16 14.12 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.445 2.097 . . . . 0.38 111.737 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.96 -8.05 53.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.199 -0.455 . . . . 0.66 111.032 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.4 t -94.22 -4.82 48.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.358 0.599 . . . . 1.5 109.676 174.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.542 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 33.9 m -87.65 143.23 27.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.601 -0.727 . . . . 0.85 111.175 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -69.24 -12.07 61.35 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.031 -0.986 . . . . 1.77 110.615 175.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.416 ' HB3' HG21 ' A' ' 51' ' ' THR . 1.4 mptp? -99.86 154.06 18.65 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 114.894 -1.048 . . . . 1.63 111.391 -174.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.415 ' HE3' ' HB3' ' A' ' 58' ' ' MET . 80.5 mmm -127.67 98.25 5.13 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.109 -0.7 . . . . 1.11 109.109 168.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.467 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.2 OUTLIER -156.36 155.59 32.45 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.869 -0.605 . . . . 0.22 111.644 -173.205 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.577 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.5 tt -130.81 119.15 21.84 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.363 -0.977 . . . . 0.1 108.363 175.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.495 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 52.2 mtm180 -101.24 146.32 27.69 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.877 0.37 . . . . 2.99 111.288 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.899 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -128.15 106.75 9.27 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.399 -0.819 . . . . 0.13 109.565 179.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.559 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.6 mp -95.71 113.97 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 122.509 0.323 . . . . 0.29 110.478 -172.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.49 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -65.25 169.22 28.57 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 121.26 -0.495 . . . . 0.54 113.194 178.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 77.3 mttt . . . . . 0 C--N 1.319 -0.739 0 CA-C-O 120.871 0.367 . . . . 0.55 110.926 177.807 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.763 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.1 t70 . . . . . 0 C--O 1.217 -0.622 0 N-CA-C 108.119 -1.067 . . . . 3.23 108.119 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -73.16 -2.24 20.79 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.847 0.314 . . . . 2.39 111.847 -170.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.8 p -71.53 -6.3 39.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.36 0.6 . . . . 2.96 110.166 171.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.763 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 17.8 ptmt -91.35 36.17 0.93 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.677 -0.692 . . . . 2.49 110.402 175.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.578 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 13.1 mmmt -44.33 113.93 0.61 Allowed 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.132 -0.692 . . . . 3.4 109.132 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.602 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.0 ttt180 -102.4 167.02 10.22 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.621 -0.718 . . . . 3.8 109.303 -168.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.501 ' N ' ' HG2' ' A' ' 72' ' ' ARG . 56.5 mttp -132.6 128.46 37.2 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.642 -0.503 . . . . 4.29 109.642 171.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -83.3 -166.06 1.26 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.026 -0.534 . . . . 4.41 110.021 -178.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -58.79 -26.16 63.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.913 0.387 . . . . 5.34 111.554 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -87.27 -7.44 57.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.937 -0.574 . . . . 5.38 111.782 -174.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.57 3.65 88.97 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.736 -0.745 . . . . 4.37 112.347 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.425 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 93.9 m-20 -71.19 139.64 50.23 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.438 -0.579 . . . . 4.51 109.438 175.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.504 ' CD ' ' HE3' ' A' ' 71' ' ' LYS . 34.3 tt0 -72.1 90.39 1.19 Allowed 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.529 -0.545 . . . . 4.28 109.529 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.602 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 31.3 m -92.68 99.51 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.168 0 CA-C-O 121.785 0.803 . . . . 3.1 109.208 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.578 ' HB ' ' HD2' ' A' ' 71' ' ' LYS . 0.8 OUTLIER -80.03 108.38 9.14 Favored Pre-proline 0 C--N 1.309 -1.165 0 N-CA-C 108.813 -0.81 . . . . 2.5 108.813 175.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.491 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 54.0 Cg_exo . . . . . 0 CA--C 1.513 -0.527 0 C-N-CA 123.363 2.709 . . . . 1.87 112.953 -170.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 78.3 m-70 . . . . . 0 N--CA 1.449 -0.496 0 N-CA-C 108.69 -0.856 . . . . 0.72 108.69 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.426 ' HA ' ' HA ' ' A' ' 61' ' ' ARG . 32.6 ttm -141.34 129.46 22.1 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.396 -0.522 . . . . 0.27 110.838 173.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.44 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.7 m-85 -118.19 127.42 53.73 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.611 -0.722 . . . . 0.27 109.565 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -80.69 153.55 27.82 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 109.825 -0.435 . . . . 1.26 109.825 177.205 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.457 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 22.1 m-85 -133.58 170.3 15.72 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.247 0.546 . . . . 0.32 111.543 -174.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -117.51 -13.86 10.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.245 -0.889 . . . . 2.38 109.927 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.526 ' HB2' HG23 ' A' ' 96' ' ' VAL . 57.1 m-80 -141.31 126.17 18.13 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.038 0.447 . . . . 1.1 110.432 -177.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.488 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.5 mmm180 -62.33 -34.13 76.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.413 -0.812 . . . . 3.09 111.816 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.7 m -63.05 -32.67 74.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.404 -0.362 . . . . 0.35 110.793 -177.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.548 ' O ' HG12 ' A' ' 100' ' ' ILE . 11.8 t -71.04 -57.45 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.23 110.284 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.577 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.6 ptp -56.53 -39.07 72.73 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.974 -0.557 . . . . 0.17 111.136 -176.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.433 ' N ' ' HG3' ' A' ' 97' ' ' MET . 16.0 t70 -65.13 -39.44 93.04 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.804 -0.358 . . . . 0.34 110.36 179.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -75.08 -39.9 60.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.247 -0.433 . . . . 1.36 111.763 -179.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.548 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.2 mm -63.89 -55.52 21.84 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.361 0 N-CA-C 108.656 -0.868 . . . . 0.12 108.656 176.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.814 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.4 ttpt -51.05 -47.51 61.75 Favored 'General case' 0 C--O 1.218 -0.565 0 O-C-N 123.827 0.704 . . . . 0.79 109.885 176.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.688 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 35.2 ttp -50.33 -56.3 11.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.626 -0.715 . . . . 0.28 110.999 177.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.708 ' O ' HG13 ' A' ' 107' ' ' ILE . 40.5 m -58.32 -53.29 59.99 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.482 0.489 . . . . 0.18 110.557 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.899 HD13 HD21 ' A' ' 62' ' ' LEU . 25.8 mt -47.23 -54.38 10.95 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.722 -0.672 . . . . 0.09 110.631 175.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.549 ' HG2' HD13 ' A' ' 48' ' ' LEU . 44.1 mt-30 -51.25 -46.63 62.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.698 -1.137 . . . . 1.2 112.223 177.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 102' ' ' MET . 18.9 mt-30 -60.04 -40.46 89.49 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-O 122.006 0.908 . . . . 2.37 108.864 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.708 HG13 ' O ' ' A' ' 103' ' ' THR . 7.4 mt -69.15 -46.5 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 CA-C-N 113.878 -1.51 . . . . 0.15 111.165 -178.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.576 HD12 HD11 ' A' ' 48' ' ' LEU . 6.0 mt -62.24 -42.19 94.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.223 -0.444 . . . . 0.19 111.635 -177.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.9 t -56.88 -29.69 63.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.655 0.264 . . . . 1.14 111.022 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -61.1 -42.11 97.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.459 0.647 . . . . 1.64 109.905 176.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -92.43 -3.93 54.49 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.217 -0.901 . . . . 0.65 110.22 -178.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 115.316 -0.856 . . . . 0.76 108.884 176.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.493 ' HA ' HD12 ' A' ' 18' ' ' ILE . 25.1 m80 . . . . . 0 CA--C 1.513 -0.472 0 N-CA-C 110.071 -0.344 . . . . 0.75 110.071 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 56.9 p -157.24 168.47 27.32 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.184 -0.607 . . . . 1.09 111.997 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.471 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 175.83 -169.11 41.72 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.108 -0.951 . . . . 0.16 110.814 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -98.07 129.07 44.92 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 117.237 0.519 . . . . 0.16 110.164 177.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.423 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -143.47 145.68 32.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.866 0.365 . . . . 0.11 111.477 -176.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.47 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 83.1 mt -102.89 129.95 53.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 116.332 -0.394 . . . . 0.33 110.091 176.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.462 ' O ' HG13 ' A' ' 12' ' ' VAL . 26.0 t80 -141.85 141.02 33.07 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 108.871 -0.788 . . . . 0.36 108.871 178.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 62.48 24.99 14.9 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.826 -0.435 . . . . 0.8 109.826 -176.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt 64.61 1.72 1.43 Allowed 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 113.54 0.941 . . . . 2.11 113.54 -177.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.462 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -95.79 125.51 48.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 108.722 -0.844 . . . . 0.22 108.722 169.633 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.446 ' HA ' HG12 ' A' ' 8' ' ' ILE . 59.4 p -75.6 145.13 41.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.799 0.333 . . . . 1.07 110.483 -176.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.462 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -160.82 -160.28 10.57 Favored Glycine 0 N--CA 1.438 -1.169 0 C-N-CA 119.742 -1.218 . . . . 0.11 113.926 -175.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.3 mm -125.71 131.76 71.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 N-CA-C 108.935 -0.765 . . . . 0.13 108.935 -179.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.56 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.33 136.98 33.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 110.272 -0.27 . . . . 0.13 110.272 -176.357 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.72 130.1 31.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.911 0.386 . . . . 0.1 111.486 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.52 HG12 HD23 ' A' ' 27' ' ' LEU . 54.7 mt -86.43 135.25 25.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 109.918 -0.401 . . . . 0.27 109.918 177.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.0 101.06 10.17 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.156 -0.475 . . . . 1.24 110.694 -176.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -114.42 169.73 8.83 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.431 -0.581 . . . . 1.2 109.431 176.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t70 76.01 -1.56 2.93 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.966 0.888 . . . . 0.58 109.96 -177.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 23' ' ' SER . 31.6 m -102.62 -174.87 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 114.472 -1.24 . . . . 0.25 109.928 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.6 ' O ' HG23 ' A' ' 22' ' ' VAL . 58.3 m -73.84 164.03 64.08 Favored Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 105.045 -2.206 . . . . 1.13 105.045 174.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -41.18 127.73 2.94 Favored 'Trans proline' 0 C--N 1.352 0.73 0 CA-C-N 121.15 1.446 . . . . 0.16 112.629 -137.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.458 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -51.49 141.27 16.16 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 113.713 -1.585 . . . . 0.1 112.164 -165.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -125.43 166.76 16.01 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 114.37 -1.286 . . . . 0.32 111.844 -170.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -115.53 105.03 12.33 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 107.422 -1.325 . . . . 0.09 107.422 173.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.8 m -99.03 106.9 19.2 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 120.933 0.397 . . . . 0.17 111.056 -176.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -84.48 132.56 34.53 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.907 -0.775 . . . . 0.14 108.907 171.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.495 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 66.6 mtt180 -124.6 159.09 31.51 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 108.463 -0.94 . . . . 1.91 108.463 174.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.0 p -71.96 177.57 4.23 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.987 -0.746 . . . . 0.6 108.987 177.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.462 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.2 p -60.19 -33.84 72.79 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.969 -0.692 . . . . 0.26 110.898 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -87.73 -31.63 19.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.76 0.79 . . . . 2.12 109.394 171.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.495 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 93.02 11.02 59.22 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 114.51 -1.223 . . . . 0.23 112.29 177.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -60.58 -45.23 94.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.343 -0.614 . . . . 1.73 109.343 173.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.5 tttm -83.52 138.68 33.31 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.652 -0.87 . . . . 1.3 108.652 172.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.454 HG23 ' HG2' ' A' ' 30' ' ' ARG . 9.8 p -143.81 139.88 25.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 120.849 0.356 . . . . 0.17 110.552 -178.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -145.09 115.19 7.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.578 -0.283 . . . . 0.41 110.321 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.436 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 50.8 m -108.19 133.74 52.03 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.607 0.595 . . . . 0.15 112.607 -174.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.35 130.17 52.66 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.587 0 N-CA-C 108.082 -1.081 . . . . 0.12 108.082 168.989 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 45' ' ' ILE . 74.5 t -93.01 120.68 42.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 O-C-N 121.193 -0.942 . . . . 0.11 109.199 173.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.596 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -68.73 -20.5 64.39 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.916 0.71 . . . . 0.08 112.916 -170.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.5 p -67.49 -18.1 64.93 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.948 -0.76 . . . . 0.87 108.948 176.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.414 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 5.3 p -109.03 14.1 24.22 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.142 -0.936 . . . . 0.15 110.07 -177.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.487 ' HA ' ' HA2' ' A' ' 64' ' ' GLY . 24.7 mm -110.06 138.76 36.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.168 -0.679 . . . . 0.12 109.168 177.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.476 ' HB2' ' HG2' ' A' ' 65' ' ' LYS . 37.2 t70 -101.84 -41.58 6.46 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.278 -0.419 . . . . 0.52 110.487 -176.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.431 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 13.1 mtmt -144.51 175.75 9.9 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.983 0.42 . . . . 1.41 111.255 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.778 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -151.81 140.35 20.65 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.704 -0.85 . . . . 0.73 108.704 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.7 mm-40 -139.72 115.89 10.44 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.047 0.385 . . . . 1.94 111.734 -173.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.496 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -111.26 144.84 39.78 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.73 0.3 . . . . 0.22 111.661 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.401 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 61.2 p -64.76 123.71 84.22 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-N 115.827 -0.624 . . . . 0.26 110.898 -177.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.439 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 35.1 Cg_exo -54.97 157.16 13.76 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.658 2.239 . . . . 0.38 111.417 175.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.59 -19.78 65.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.224 -0.444 . . . . 0.66 111.814 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 t -93.29 -14.45 26.96 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.166 0.508 . . . . 1.5 110.443 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.439 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 17.6 m -65.95 137.39 57.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.672 -0.695 . . . . 0.85 111.299 177.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -50.55 -34.86 27.15 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-N 114.748 -1.115 . . . . 1.77 110.419 172.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.494 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 34.4 mmtt -86.3 149.99 24.66 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 113.449 -1.705 . . . . 1.63 112.123 -171.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.403 ' O ' ' HG3' ' A' ' 59' ' ' MET . 4.3 mtp -128.82 98.53 5.0 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.831 -1.077 . . . . 1.11 109.238 171.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.51 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.4 OUTLIER -156.49 156.33 33.54 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.651 -0.704 . . . . 0.22 111.045 -171.888 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -129.87 119.07 22.71 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.049 -1.093 . . . . 0.1 108.049 175.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.519 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 47.9 mtm180 -99.97 141.98 32.06 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.208 0.528 . . . . 2.99 110.788 -178.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.956 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -120.36 104.62 10.18 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 114.97 -1.014 . . . . 0.13 108.814 177.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.521 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.9 mp -84.37 97.21 4.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.285 -0.635 . . . . 0.29 109.285 -174.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.487 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -72.59 148.68 42.32 Favored Glycine 0 N--CA 1.442 -0.942 0 CA-C-N 115.461 -0.791 . . . . 0.54 111.904 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.476 ' HG2' ' HB2' ' A' ' 46' ' ' ASP . 91.9 mttt . . . . . 0 C--N 1.313 -1.001 0 CA-C-O 121.027 0.441 . . . . 0.55 111.793 -176.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.67 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 12.7 m-20 . . . . . 0 N--CA 1.449 -0.496 0 N-CA-C 108.384 -0.969 . . . . 3.23 108.384 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.47 -2.88 3.65 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.187 -0.46 . . . . 2.39 112.039 -171.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.7 p -67.9 -16.1 63.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.376 0.608 . . . . 2.96 110.336 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.5 ptpt -79.55 42.88 0.53 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.584 -0.735 . . . . 2.49 111.188 177.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -44.24 116.68 1.06 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.328 0.585 . . . . 3.4 109.921 -176.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.407 ' HG2' ' N ' ' A' ' 73' ' ' LYS . 77.0 ttt180 -105.89 165.83 10.92 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.072 -0.967 . . . . 3.8 109.853 -166.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.596 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 61.7 mttp -130.63 139.35 50.38 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.925 -0.398 . . . . 4.29 109.925 170.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.48 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 2.9 p-10 -86.62 -168.6 2.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.017 -0.538 . . . . 4.41 110.377 -177.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -58.9 -31.2 68.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.705 0.288 . . . . 5.34 111.618 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.48 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 16.5 mt-10 -80.18 -14.9 58.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 5.38 110.898 -179.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.94 16.54 59.43 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.738 -0.744 . . . . 4.37 111.695 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.596 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 53.4 m-20 -77.11 138.98 39.84 Favored 'General case' 0 CA--C 1.512 -0.519 0 N-CA-C 109.043 -0.725 . . . . 4.51 109.043 178.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -69.79 90.08 0.59 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.49 -0.559 . . . . 4.28 109.49 176.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 27.9 m -96.32 123.87 48.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.565 0.698 . . . . 3.1 110.044 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.468 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 t -90.59 122.47 67.07 Favored Pre-proline 0 C--N 1.313 -1.002 0 N-CA-C 108.452 -0.944 . . . . 2.5 108.452 177.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 33.4 Cg_exo . . . . . 0 CA--C 1.513 -0.574 0 C-N-CA 123.009 2.473 . . . . 1.87 111.642 -176.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.519 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 77.4 m-70 . . . . . 0 C--O 1.22 -0.499 0 N-CA-C 107.785 -1.191 . . . . 0.72 107.785 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.51 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 27.6 ttm -140.29 125.91 19.17 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 118.891 0.769 . . . . 0.27 111.775 175.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.438 ' O ' ' HA ' ' A' ' 59' ' ' MET . 10.1 m-85 -112.82 127.26 56.12 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.39 -0.823 . . . . 0.27 109.842 178.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.12 149.51 29.13 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.924 0.392 . . . . 1.26 110.284 177.388 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.455 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 25.0 m-85 -131.71 174.16 10.41 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.297 0.57 . . . . 0.32 111.533 -174.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -119.51 -21.18 7.5 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.017 -0.992 . . . . 2.38 109.572 175.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.593 ' HB2' HG23 ' A' ' 96' ' ' VAL . 11.1 m120 -130.55 126.89 37.9 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.046 -0.525 . . . . 1.1 110.525 -173.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.567 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 10.6 mmm180 -64.4 -32.86 74.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.627 -0.715 . . . . 3.09 111.874 178.083 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.2 m -62.34 -39.0 91.65 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.89 0.376 . . . . 0.35 110.937 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.593 HG23 ' HB2' ' A' ' 93' ' ' ASN . 13.0 t -67.84 -55.21 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-N 116.025 -0.534 . . . . 0.23 110.384 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.617 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.2 ptp -59.05 -36.15 74.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.268 -0.424 . . . . 0.17 111.05 -176.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -64.35 -45.53 87.37 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.55 -0.296 . . . . 0.34 110.274 176.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -70.2 -42.91 71.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.999 -0.546 . . . . 1.36 111.868 -177.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.599 HG22 HD11 ' A' ' 104' ' ' LEU . 38.8 mm -61.41 -55.93 21.2 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 109.024 -0.732 . . . . 0.12 109.024 178.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.813 ' HA ' HD12 ' A' ' 104' ' ' LEU . 21.2 ttpp -51.36 -51.23 56.37 Favored 'General case' 0 C--O 1.218 -0.584 0 O-C-N 123.742 0.652 . . . . 0.79 110.05 177.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.596 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 45.8 ttp -46.82 -53.45 11.98 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.061 -0.972 . . . . 0.28 111.365 177.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.72 ' O ' HG13 ' A' ' 107' ' ' ILE . 20.0 m -62.56 -52.23 64.23 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.201 -0.454 . . . . 0.18 110.751 179.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.956 HD13 HD21 ' A' ' 62' ' ' LEU . 33.0 mt -47.22 -53.36 13.45 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.646 0.736 . . . . 0.09 110.62 175.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.768 ' HG2' HD13 ' A' ' 48' ' ' LEU . 57.4 mt-30 -55.29 -39.8 70.32 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.258 -1.337 . . . . 1.2 112.125 177.43 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.596 ' HG2' ' O ' ' A' ' 102' ' ' MET . 25.9 mm-40 -69.25 -25.67 64.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.556 0.693 . . . . 2.37 110.218 178.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.72 HG13 ' O ' ' A' ' 103' ' ' THR . 18.4 mt -82.18 -46.15 19.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 114.952 -1.022 . . . . 0.15 111.08 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.778 HD12 HD11 ' A' ' 48' ' ' LEU . 11.0 mt -62.68 -40.4 88.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.039 -0.528 . . . . 0.19 111.541 -176.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.5 p -61.44 -20.63 63.32 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.373 -0.376 . . . . 1.14 111.802 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -66.28 -51.99 51.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.587 0.708 . . . . 1.64 109.309 173.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -78.18 -16.58 57.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.081 -0.963 . . . . 0.65 110.374 -178.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 115.392 -0.822 . . . . 0.76 109.329 174.356 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 70.7 m80 . . . . . 0 N--CA 1.473 0.679 0 N-CA-C 112.235 0.457 . . . . 0.75 112.235 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.0 p -150.63 165.31 33.76 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.089 0.774 . . . . 1.09 113.089 -170.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.487 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . -179.76 -161.8 27.65 Favored Glycine 0 N--CA 1.443 -0.862 0 CA-C-N 114.472 -1.24 . . . . 0.16 110.434 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.92 133.53 47.88 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.438 0.619 . . . . 0.16 110.407 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.611 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -147.47 148.1 30.89 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.17 0.433 . . . . 0.11 112.17 -176.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.816 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.7 mt -107.66 124.19 63.54 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-O 120.818 0.342 . . . . 0.33 110.915 177.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -123.78 133.81 53.76 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.739 -0.837 . . . . 0.36 108.739 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 53.95 32.06 14.62 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 122.804 0.441 . . . . 0.8 110.947 -177.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.4 mtpt 70.98 -1.82 2.55 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.435 0.902 . . . . 2.11 113.435 178.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.4 p -92.56 118.78 38.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.792 -0.818 . . . . 0.22 108.792 169.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.412 ' HA ' HG12 ' A' ' 8' ' ' ILE . 79.3 p -72.93 145.93 46.45 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.161 -0.472 . . . . 1.07 110.656 -176.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . 0.435 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -163.82 -157.44 9.35 Favored Glycine 0 N--CA 1.439 -1.164 0 C-N-CA 120.106 -1.045 . . . . 0.11 113.214 -177.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.1 mm -126.17 132.12 70.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 109.404 -0.591 . . . . 0.13 109.404 -178.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.548 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -100.74 134.89 39.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.859 -0.423 . . . . 0.13 109.859 -177.453 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.4 128.78 28.12 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.502 -0.317 . . . . 0.1 111.443 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.426 HD13 ' HB ' ' A' ' 103' ' ' THR . 46.9 mt -85.46 138.67 18.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 121.267 0.556 . . . . 0.27 109.973 175.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.403 HD22 ' HA ' ' A' ' 19' ' ' ASN . 0.9 OUTLIER -110.42 103.28 11.9 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 114.917 -1.038 . . . . 1.24 110.947 -175.24 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -116.58 169.05 9.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.319 -0.623 . . . . 1.2 109.319 175.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.7 t70 78.35 -3.31 2.31 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 122.251 1.025 . . . . 0.58 109.664 -176.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 23' ' ' SER . 27.1 m -102.82 -174.55 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 113.918 -1.492 . . . . 0.25 109.331 178.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.638 ' O ' HG23 ' A' ' 22' ' ' VAL . 64.6 m -72.94 167.92 29.46 Favored Pre-proline 0 C--N 1.314 -0.964 0 N-CA-C 105.404 -2.073 . . . . 1.13 105.404 175.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.417 ' O ' HG13 ' A' ' 41' ' ' VAL . 93.7 Cg_exo -41.15 129.34 3.11 Favored 'Trans proline' 0 C--N 1.354 0.82 0 CA-C-N 121.166 1.452 . . . . 0.16 112.531 -141.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -52.83 138.75 28.76 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 114.182 -1.372 . . . . 0.1 112.2 -162.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -118.89 167.44 11.72 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.094 -0.957 . . . . 0.32 111.797 -171.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.796 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -116.75 105.59 12.56 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 106.988 -1.486 . . . . 0.09 106.988 170.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.411 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.0 m -102.43 106.28 16.99 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 120.885 0.374 . . . . 0.17 110.801 -174.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -86.29 129.42 34.86 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 109.009 -0.737 . . . . 0.14 109.009 173.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.469 ' HG2' HG23 ' A' ' 37' ' ' VAL . 73.4 mtt180 -124.15 157.48 34.57 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.365 -0.976 . . . . 1.91 108.365 173.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 p -68.08 175.45 3.16 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.076 -0.712 . . . . 0.6 109.076 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.435 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 7.0 p -57.27 -44.27 83.8 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 118.362 0.528 . . . . 0.26 110.678 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -82.73 -26.38 32.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.753 -0.658 . . . . 2.12 109.719 172.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.13 16.49 47.17 Favored Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.184 -0.916 . . . . 0.23 112.885 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -62.16 -54.03 46.85 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.478 -0.564 . . . . 1.73 109.478 174.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt -80.93 140.3 35.37 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.517 -0.765 . . . . 1.3 109.186 176.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.469 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.9 p -149.32 134.81 11.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.022 0.439 . . . . 0.17 111.078 -178.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -139.83 129.16 24.01 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.484 -0.561 . . . . 0.41 109.484 178.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.411 ' OG1' HG23 ' A' ' 28' ' ' THR . 25.1 m -117.56 129.26 55.67 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.262 0.468 . . . . 0.15 112.262 -172.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.796 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -97.3 128.99 48.02 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.629 0 N-CA-C 107.797 -1.186 . . . . 0.12 107.797 168.775 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.417 HG13 ' O ' ' A' ' 24' ' ' PRO . 68.0 t -92.72 120.8 42.68 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 N-CA-C 108.208 -1.034 . . . . 0.11 108.208 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -67.04 -20.7 65.89 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.19 0.811 . . . . 0.08 113.19 -169.036 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.7 p -68.41 -15.53 63.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.225 0.536 . . . . 0.87 109.906 175.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.2 p -106.26 9.93 31.91 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.531 -0.758 . . . . 0.15 109.874 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.528 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.7 mm -111.9 143.33 21.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.876 -0.602 . . . . 0.12 109.515 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -107.03 -44.69 4.33 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.392 -0.367 . . . . 0.52 110.72 -178.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.49 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 9.6 mtmm -138.92 171.53 14.19 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.452 -0.34 . . . . 1.41 111.212 -176.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.606 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -150.64 135.4 17.4 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.21 -0.663 . . . . 0.73 109.21 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.537 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 79.7 mm-40 -131.57 120.11 22.43 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 111.934 0.346 . . . . 1.94 111.934 -170.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.18 141.93 47.49 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 121.974 -0.454 . . . . 0.22 111.937 -177.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.6 p -68.58 121.96 82.88 Favored Pre-proline 0 N--CA 1.464 0.261 0 CA-C-N 115.848 -0.615 . . . . 0.26 110.712 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.465 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 11.1 Cg_exo -59.57 161.08 18.5 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.395 2.063 . . . . 0.38 111.433 175.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.84 -23.51 66.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.003 0.43 . . . . 0.66 110.748 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 42.5 m -76.41 -19.26 58.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.641 . . . . 1.5 110.648 176.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.465 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 73.2 m -78.15 134.47 37.65 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.373 -0.831 . . . . 0.85 110.316 177.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -57.96 -26.49 62.36 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 121.708 0.765 . . . . 1.77 110.673 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.588 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 42.4 mmtm -77.81 151.74 33.81 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 114.56 -1.2 . . . . 1.63 111.435 -176.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.534 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -127.31 95.57 4.31 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 107.927 -1.138 . . . . 1.11 107.927 168.628 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.588 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.13 151.66 28.54 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 121.62 0.724 . . . . 0.22 112.084 -173.537 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.9 tt -127.76 119.32 25.5 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.408 -1.269 . . . . 0.1 107.936 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.567 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 30.3 mtm180 -101.01 144.98 29.29 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.111 0.481 . . . . 2.99 111.119 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.915 HD21 HD13 ' A' ' 104' ' ' LEU . 1.1 mm? -122.64 106.18 10.74 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.208 -0.905 . . . . 0.13 109.097 178.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.527 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -85.34 98.77 6.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.742 -0.466 . . . . 0.29 109.742 -173.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.478 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -74.03 136.73 22.03 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.752 -0.658 . . . . 0.54 112.443 -178.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.476 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 82.0 mttt . . . . . 0 C--N 1.322 -0.596 0 N-CA-C 112.831 0.678 . . . . 0.55 112.831 -176.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.696 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 15.3 t70 . . . . . 0 C--O 1.211 -0.96 0 N-CA-C 109.222 -0.659 . . . . 3.23 109.222 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -65.65 -3.49 4.78 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.676 0.621 . . . . 2.39 112.676 -169.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.0 p -75.89 -7.93 55.7 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.26 0.552 . . . . 2.96 110.239 170.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.696 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.9 ptmt -80.17 37.45 0.38 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.44 -0.8 . . . . 2.49 110.719 176.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.532 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 29.8 mmtm -45.23 114.54 0.75 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.945 -0.571 . . . . 3.4 110.354 -175.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.0 ttt180 -91.26 158.88 16.33 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 107.909 -1.145 . . . . 3.8 107.909 -176.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 97.3 mttt -134.4 140.56 46.38 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 109.535 -0.543 . . . . 4.29 109.535 174.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.46 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 1.6 p-10 -80.14 -169.46 2.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.126 -0.488 . . . . 4.41 110.527 -177.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -58.53 -31.75 68.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.727 0.298 . . . . 5.34 111.662 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.519 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 16.5 mt-10 -83.7 -32.42 25.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.744 0.307 . . . . 5.38 110.921 -178.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 113.78 18.24 7.04 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.594 -0.813 . . . . 4.37 112.32 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.519 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 32.2 m-80 -76.11 131.81 39.65 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.172 -0.677 . . . . 4.51 109.172 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.08 96.38 0.62 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.098 0.475 . . . . 4.28 109.932 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.7 m -105.45 99.32 8.24 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-O 121.605 0.716 . . . . 3.1 109.077 177.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.532 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -87.53 121.31 71.16 Favored Pre-proline 0 C--N 1.312 -1.033 0 CA-C-N 116.078 -0.51 . . . . 2.5 110.2 -177.723 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.447 ' HG2' ' HE2' ' A' ' 70' ' ' LYS . 52.1 Cg_exo . . . . . 0 N--CA 1.458 -0.608 0 C-N-CA 122.975 2.45 . . . . 1.87 112.135 -178.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.567 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 66.0 m-70 . . . . . 0 CA--C 1.509 -0.604 0 N-CA-C 107.497 -1.297 . . . . 0.72 107.497 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 35.2 ttm -140.4 127.11 20.4 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 119.687 -0.805 . . . . 0.27 111.666 179.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.596 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.0 m-85 -118.11 130.04 55.9 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.418 -0.81 . . . . 0.27 109.536 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.816 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -79.71 159.33 26.68 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.718 -0.475 . . . . 1.26 109.718 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.475 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 28.8 m-85 -138.73 175.33 9.65 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 120.752 0.311 . . . . 0.32 110.765 -178.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -124.02 -12.3 7.49 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.851 -0.613 . . . . 2.38 109.823 173.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.536 ' HB2' HG23 ' A' ' 96' ' ' VAL . 46.6 m-80 -138.06 128.3 26.03 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.067 -0.515 . . . . 1.1 110.252 -177.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.55 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 13.9 mmm180 -67.24 -30.23 70.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.528 -0.76 . . . . 3.09 111.85 -179.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.9 m -61.88 -39.8 93.18 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.979 0.418 . . . . 0.35 110.549 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.578 ' O ' HG12 ' A' ' 100' ' ' ILE . 8.1 t -65.92 -56.03 16.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.899 -0.591 . . . . 0.23 110.4 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.583 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.8 ptp -57.44 -38.03 73.78 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 116.235 -0.439 . . . . 0.17 111.067 -176.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.53 -43.58 93.54 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.449 -0.5 . . . . 0.34 110.466 177.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -70.65 -39.28 73.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.141 -0.482 . . . . 1.36 111.585 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.606 HG22 HD11 ' A' ' 104' ' ' LEU . 34.0 mm -63.89 -56.99 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 108.895 -0.779 . . . . 0.12 108.895 175.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.797 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.1 ttpt -49.99 -48.75 52.2 Favored 'General case' 0 C--O 1.22 -0.47 0 O-C-N 123.926 0.766 . . . . 0.79 109.793 176.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.684 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 41.9 ttp -49.09 -56.36 9.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.54 -0.755 . . . . 0.28 111.201 177.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.728 ' O ' HG13 ' A' ' 107' ' ' ILE . 32.3 m -58.5 -53.49 57.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.15 -0.477 . . . . 0.18 110.596 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.915 HD13 HD21 ' A' ' 62' ' ' LEU . 26.1 mt -47.5 -53.61 13.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.705 -0.68 . . . . 0.09 110.569 175.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.571 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.9 mt-30 -53.36 -44.06 68.27 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.524 -1.216 . . . . 1.2 112.182 176.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.684 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.7 mt-30 -62.95 -35.75 81.16 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.753 0.787 . . . . 2.37 109.086 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.728 HG13 ' O ' ' A' ' 103' ' ' THR . 9.3 mt -74.43 -45.63 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-N 114.326 -1.307 . . . . 0.15 111.417 -177.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.551 HD12 HD11 ' A' ' 48' ' ' LEU . 8.8 mt -63.8 -40.66 89.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.449 -0.341 . . . . 0.19 111.699 -177.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.7 t -56.31 -24.76 45.66 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.979 0.418 . . . . 1.14 111.045 -178.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -65.65 -40.94 93.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.214 0.53 . . . . 1.64 110.255 176.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -90.9 -16.78 27.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.635 -0.711 . . . . 0.65 109.984 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.427 0 CA-C-N 115.135 -0.939 . . . . 0.76 109.215 175.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.424 ' CD2' HG21 ' A' ' 103' ' ' THR . 39.3 m80 . . . . . 0 CA--C 1.519 -0.242 0 CA-C-O 120.86 0.362 . . . . 0.75 110.17 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.0 p -143.79 168.23 20.43 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.967 0.413 . . . . 1.09 111.541 -174.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.476 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 179.77 -159.01 23.18 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 110.824 -0.911 . . . . 0.16 110.824 -178.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.5 135.72 47.52 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 117.133 0.467 . . . . 0.16 110.176 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.542 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -151.68 140.78 21.22 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.043 0.386 . . . . 0.11 112.043 -177.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.751 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 87.0 mt -99.32 126.76 52.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.838 -0.43 . . . . 0.33 109.838 173.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -125.95 135.19 51.57 Favored 'General case' 0 C--O 1.215 -0.731 0 N-CA-C 108.433 -0.951 . . . . 0.36 108.433 178.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 57.98 26.04 12.97 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 122.68 0.392 . . . . 0.8 110.754 -177.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm 69.46 1.04 3.15 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.876 0.695 . . . . 2.11 112.876 -177.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.6 p -92.54 120.81 42.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 108.55 -0.907 . . . . 0.22 108.55 168.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.468 ' HA ' HG12 ' A' ' 8' ' ' ILE . 16.2 p -74.84 143.14 44.05 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.749 -0.66 . . . . 1.07 111.266 -174.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.82 -158.59 9.79 Favored Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.461 -0.876 . . . . 0.11 113.436 -177.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.412 HG23 ' O ' ' A' ' 5' ' ' GLY . 20.4 mm -127.78 132.6 68.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 C-N-CA 123.396 0.679 . . . . 0.13 109.362 -176.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.505 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -101.61 135.41 38.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.903 -0.406 . . . . 0.13 109.903 -176.708 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.15 130.21 28.62 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.499 0.19 . . . . 0.1 111.433 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.439 HD13 ' HB ' ' A' ' 103' ' ' THR . 53.8 mt -85.35 136.47 22.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.365 0.603 . . . . 0.27 109.921 175.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -108.47 99.7 9.06 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.935 -1.03 . . . . 1.24 111.038 -173.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.511 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 23.8 mt-10 -112.31 171.14 7.69 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.421 -0.955 . . . . 1.2 108.421 174.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.511 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 33.7 t70 79.68 -6.37 1.8 Allowed 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 122.44 1.114 . . . . 0.58 109.499 -177.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 23' ' ' SER . 23.4 m -103.53 -171.44 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 113.76 -1.564 . . . . 0.25 109.943 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.675 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.2 p -72.02 168.62 21.24 Favored Pre-proline 0 C--N 1.319 -0.737 0 N-CA-C 105.31 -2.107 . . . . 1.13 105.31 174.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . 0.434 ' O ' HG13 ' A' ' 41' ' ' VAL . 72.8 Cg_exo -41.17 128.4 3.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 CA-C-N 121.594 1.605 . . . . 0.16 112.511 -146.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.539 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -49.2 139.9 10.41 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 114.195 -1.366 . . . . 0.1 112.482 -164.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -121.69 168.96 11.19 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 114.687 -1.142 . . . . 0.32 111.375 -170.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.887 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.99 107.02 13.54 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 107.141 -1.429 . . . . 0.09 107.141 170.258 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.572 HG23 ' OG1' ' A' ' 39' ' ' THR . 3.3 m -103.84 106.51 17.04 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-O 120.795 0.331 . . . . 0.17 110.875 -174.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.5 t90 -85.76 129.56 34.79 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 108.853 -0.795 . . . . 0.14 108.853 172.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.562 ' HG2' HG23 ' A' ' 37' ' ' VAL . 97.9 mtt180 -124.97 157.43 36.12 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.871 -0.789 . . . . 1.91 108.871 174.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -69.84 176.26 3.78 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.849 -0.426 . . . . 0.6 109.849 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.2 p -61.45 -30.58 70.67 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.237 -0.585 . . . . 0.26 111.258 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -94.94 -20.25 19.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.494 0.664 . . . . 2.12 109.626 171.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 84.7 17.15 64.31 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 114.824 -1.08 . . . . 0.23 112.635 177.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -67.38 -51.07 56.44 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.191 -0.67 . . . . 1.73 109.191 173.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -78.84 139.09 38.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.892 -0.781 . . . . 1.3 108.892 173.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.562 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.7 p -149.14 136.23 13.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 120.913 0.387 . . . . 0.17 110.739 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -144.2 127.0 16.25 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.77 -0.456 . . . . 0.41 109.77 177.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.572 ' OG1' HG23 ' A' ' 28' ' ' THR . 31.4 m -117.63 132.93 56.43 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.406 0.521 . . . . 0.15 112.406 -172.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.887 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -99.88 129.45 50.49 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 107.93 -1.137 . . . . 0.12 107.93 168.422 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.434 HG13 ' O ' ' A' ' 24' ' ' PRO . 93.3 t -93.25 121.59 44.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 O-C-N 121.044 -1.035 . . . . 0.11 108.544 172.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.577 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -67.37 -21.24 65.62 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.32 0.859 . . . . 0.08 113.32 -169.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.1 p -69.37 -13.74 62.53 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.223 -0.591 . . . . 0.87 109.673 175.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . 0.431 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 3.8 p -110.75 11.79 22.55 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.384 -0.826 . . . . 0.15 109.785 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.526 HG21 ' CD1' ' A' ' 62' ' ' LEU . 26.6 mm -110.75 140.76 28.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.071 -0.714 . . . . 0.12 109.071 177.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.411 ' HB2' ' HG2' ' A' ' 65' ' ' LYS . 38.8 t70 -104.8 -41.73 5.56 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.344 -0.389 . . . . 0.52 110.934 -177.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.495 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 9.7 mtmm -140.82 171.73 13.68 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.768 0.318 . . . . 1.41 111.247 -177.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.601 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -150.45 146.48 26.68 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.518 -0.919 . . . . 0.73 108.518 177.622 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.584 ' HG3' HD11 ' A' ' 63' ' ' ILE . 0.5 OUTLIER -142.68 120.96 12.28 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 121.211 -0.195 . . . . 1.94 110.943 -174.298 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.477 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -117.2 152.16 35.37 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.9 -0.5 . . . . 0.22 111.467 -179.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.544 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 70.5 p -77.64 119.53 77.78 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.884 -0.598 . . . . 0.26 110.786 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.536 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 9.9 Cg_exo -60.7 165.47 11.63 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 122.711 2.274 . . . . 0.38 112.015 175.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.77 -21.29 63.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.146 0.498 . . . . 0.66 110.692 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 70.6 m -78.91 -16.94 56.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.758 -0.655 . . . . 1.5 110.961 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.536 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 30.1 m -77.32 142.07 39.59 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.802 0.811 . . . . 0.85 112.512 -177.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -55.4 -30.63 60.76 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 113.921 -1.49 . . . . 1.77 110.93 172.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.495 ' HB3' HG21 ' A' ' 51' ' ' THR . 3.0 mptp? -93.27 156.2 16.96 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 114.025 -1.443 . . . . 1.63 111.966 -173.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.544 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 73.6 mmm -132.52 98.66 4.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.464 -0.789 . . . . 1.11 109.206 168.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.495 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.0 OUTLIER -158.18 159.49 36.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.573 -0.74 . . . . 0.22 111.395 -170.286 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.6 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.5 tt -134.81 120.14 19.01 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.819 -0.808 . . . . 0.1 108.819 177.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.451 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 1.9 mtp180 -105.33 146.46 29.35 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.1 0.476 . . . . 2.99 111.787 -176.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.913 HD21 HD13 ' A' ' 104' ' ' LEU . 1.1 mm? -127.4 114.67 17.83 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.088 -0.96 . . . . 0.13 109.648 -177.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.584 HD11 ' HG3' ' A' ' 49' ' ' GLN . 1.8 mp -90.74 102.26 13.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 120.936 0.398 . . . . 0.29 110.826 -172.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.488 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -70.56 137.0 26.79 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.732 -0.667 . . . . 0.54 111.972 178.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.431 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 90.5 mttt . . . . . 0 C--N 1.319 -0.74 0 CA-C-O 121.305 0.574 . . . . 0.55 112.39 -175.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 . . . . . 0 N--CA 1.449 -0.498 0 N-CA-C 109.416 -0.587 . . . . 3.23 109.416 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -76.14 -2.47 31.19 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.275 0.559 . . . . 2.39 110.465 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 p -92.13 2.2 56.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.692 -0.686 . . . . 2.96 109.952 172.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 4.3 ptmm? -90.57 20.56 4.52 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.588 -0.733 . . . . 2.49 110.285 -178.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.2 mtmt -40.95 114.9 0.52 Allowed 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.765 0.793 . . . . 3.4 111.031 -158.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 78.3 ttt180 -88.38 163.93 15.77 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.345 -1.298 . . . . 3.8 109.131 -168.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 93.4 mttt -129.49 143.1 50.69 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.287 -0.634 . . . . 4.29 109.287 172.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 40.5 p30 -82.25 -167.43 1.57 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.301 -0.409 . . . . 4.41 110.766 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -69.42 -20.47 63.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.776 0.322 . . . . 5.34 111.56 -177.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.538 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 17.0 mt-10 -89.12 -28.17 20.25 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.039 0.447 . . . . 5.38 109.966 -178.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 109.89 16.99 10.01 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.97 -0.633 . . . . 4.37 111.912 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.538 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 45.0 m-80 -78.46 138.94 38.71 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.51 -0.552 . . . . 4.51 109.51 178.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -70.15 102.03 1.99 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.29 -0.633 . . . . 4.28 109.29 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.578 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 15.8 m -113.43 98.69 7.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-O 121.791 0.805 . . . . 3.1 109.281 177.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.4 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 p -92.1 112.81 56.81 Favored Pre-proline 0 C--N 1.315 -0.903 0 CA-C-O 121.256 0.551 . . . . 2.5 110.154 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.492 ' HG2' ' HD3' ' A' ' 70' ' ' LYS . 87.9 Cg_exo . . . . . 0 CA--C 1.518 -0.318 0 C-N-CA 123.683 2.922 . . . . 1.87 112.985 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 85.7 m-70 . . . . . 0 C--O 1.222 -0.372 0 N-CA-C 108.082 -1.081 . . . . 0.72 108.082 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.495 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 28.0 ttm -141.02 140.16 34.26 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 118.278 0.49 . . . . 0.27 110.586 174.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.542 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 13.4 m-85 -125.38 158.53 34.06 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 108.468 -0.938 . . . . 0.27 108.468 171.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.751 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 5.2 p -99.12 160.42 14.28 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 109.136 -0.69 . . . . 1.26 109.136 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . 0.6 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 38.5 m-85 -145.87 162.82 36.86 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.156 0.503 . . . . 0.32 111.746 176.056 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -123.08 0.5 9.08 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.486 -0.779 . . . . 2.38 109.836 174.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.443 ' HB2' HG23 ' A' ' 96' ' ' VAL . 48.2 m-80 -146.85 126.82 13.63 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.661 -0.7 . . . . 1.1 109.922 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.633 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.8 mmm180 -66.26 -38.59 88.19 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.184 -0.462 . . . . 3.09 111.584 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.3 m -62.45 -24.22 67.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.05 0.453 . . . . 0.35 110.505 -175.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.624 ' O ' HG12 ' A' ' 100' ' ' ILE . 11.9 t -76.14 -59.58 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 N-CA-C 109.537 -0.542 . . . . 0.23 109.537 173.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.633 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.2 ptp -58.23 -41.78 84.86 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.602 -0.272 . . . . 0.17 111.161 -176.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.518 ' N ' ' HG3' ' A' ' 97' ' ' MET . 32.4 t70 -60.61 -40.81 93.2 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.097 -0.641 . . . . 0.34 110.39 177.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 14.0 m-20 -74.12 -40.91 62.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.177 -0.465 . . . . 1.36 111.744 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 96' ' ' VAL . 34.4 mm -61.08 -56.96 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.333 0 N-CA-C 108.51 -0.922 . . . . 0.12 108.51 175.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.799 ' HA ' HD12 ' A' ' 104' ' ' LEU . 30.0 ttpt -50.96 -50.17 58.62 Favored 'General case' 0 C--O 1.216 -0.674 0 O-C-N 124.033 0.833 . . . . 0.79 109.72 177.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.494 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.5 ttp -49.91 -55.31 14.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.757 -0.656 . . . . 0.28 111.273 178.212 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.728 ' O ' HG13 ' A' ' 107' ' ' ILE . 53.6 m -57.44 -54.58 45.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.136 -0.484 . . . . 0.18 110.353 178.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.913 HD13 HD21 ' A' ' 62' ' ' LEU . 26.8 mt -46.97 -56.13 6.94 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 123.333 0.653 . . . . 0.09 110.714 176.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.55 ' HG2' HD13 ' A' ' 48' ' ' LEU . 46.6 mt-30 -49.47 -47.43 48.45 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.693 -1.139 . . . . 1.2 112.032 177.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 102' ' ' MET . 15.9 mm100 -65.99 -36.78 84.23 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.786 0.803 . . . . 2.37 109.903 -177.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.728 HG13 ' O ' ' A' ' 103' ' ' THR . 8.3 mt -69.12 -44.38 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 CA-C-N 114.526 -1.216 . . . . 0.15 110.721 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.0 mt -64.56 -43.51 96.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.188 -0.46 . . . . 0.19 111.315 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.7 t -55.05 -28.51 52.81 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.213 0.32 . . . . 1.14 111.144 -178.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 106' ' ' GLN . 91.8 mtt180 -60.5 -51.02 71.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.482 0.658 . . . . 1.64 109.671 175.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -80.88 -15.13 57.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.339 -0.846 . . . . 0.65 110.468 -179.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.488 0 N-CA-C 109.074 -0.713 . . . . 0.76 109.074 175.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' HIS . . . . . 0.594 ' HB2' HD12 ' A' ' 18' ' ' ILE . 22.4 p-80 . . . . . 0 CA--C 1.512 -0.507 0 CA-C-O 121.829 0.823 . . . . 0.75 109.412 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 55.0 p -160.46 148.25 16.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.09 -0.959 . . . . 1.09 110.584 171.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.421 ' O ' HG23 ' A' ' 15' ' ' ILE . . . -175.21 -153.81 10.58 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.105 -0.798 . . . . 0.16 111.105 -177.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.63 140.28 38.26 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 117.09 0.445 . . . . 0.16 110.001 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ALA . . . . . 0.453 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -152.04 144.36 24.02 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.071 0.462 . . . . 0.11 111.506 -178.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.576 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 81.8 mt -109.75 106.59 21.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.063 -0.517 . . . . 0.33 110.415 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -106.3 138.65 42.1 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 108.762 -0.829 . . . . 0.36 108.762 -178.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 53.66 22.17 2.96 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.912 0.485 . . . . 0.8 111.504 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt 66.97 16.84 10.44 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.906 -0.588 . . . . 2.11 111.724 -178.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.438 HG13 ' CH2' ' A' ' 29' ' ' TRP . 2.3 p -102.52 117.35 47.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 107.467 -1.309 . . . . 0.22 107.467 163.429 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -74.4 145.32 43.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.994 0.425 . . . . 1.07 111.093 -172.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -166.49 -159.38 12.17 Favored Glycine 0 N--CA 1.437 -1.299 0 C-N-CA 120.111 -1.043 . . . . 0.11 113.408 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.421 HG23 ' O ' ' A' ' 5' ' ' GLY . 14.7 mm -124.89 132.09 71.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 114.94 -0.63 . . . . 0.13 109.475 -176.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.531 HD11 HD11 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -101.24 134.16 42.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.794 -0.447 . . . . 0.13 109.794 -177.696 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.29 124.37 22.95 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.364 -0.38 . . . . 0.1 110.933 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ILE . . . . . 0.634 HG12 HD23 ' A' ' 27' ' ' LEU . 22.8 mt -84.58 127.17 40.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.385 -0.598 . . . . 0.27 109.385 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -97.7 101.87 13.48 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.864 -0.607 . . . . 1.24 110.533 -173.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -116.41 169.05 9.61 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.136 -0.69 . . . . 1.2 109.136 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.9 t70 75.92 -1.63 2.93 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 122.151 0.977 . . . . 0.58 109.971 -177.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 23' ' ' SER . 32.7 m -103.06 -173.89 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 114.249 -1.341 . . . . 0.25 109.848 179.223 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.635 ' O ' HG23 ' A' ' 22' ' ' VAL . 47.8 m -72.92 167.51 33.28 Favored Pre-proline 0 C--N 1.319 -0.753 0 N-CA-C 105.157 -2.164 . . . . 1.13 105.157 173.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -41.53 126.82 3.15 Favored 'Trans proline' 0 C--N 1.357 0.974 0 CA-C-N 121.413 1.54 . . . . 0.16 112.27 -140.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -51.35 140.76 16.6 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-N 114.227 -1.351 . . . . 0.1 112.371 -165.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -124.33 169.13 12.1 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 114.126 -1.397 . . . . 0.32 111.506 -169.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.68 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -117.32 104.61 11.32 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.471 -1.307 . . . . 0.09 107.471 173.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.428 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.6 m -100.07 106.16 17.88 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 120.795 -0.362 . . . . 0.17 110.593 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.438 ' CH2' HG13 ' A' ' 12' ' ' VAL . 81.6 t90 -87.07 131.48 34.11 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.697 -0.853 . . . . 0.14 108.697 171.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.501 ' HG2' HG23 ' A' ' 37' ' ' VAL . 72.3 mtt180 -126.01 158.58 34.96 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.969 -0.752 . . . . 1.91 108.969 174.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.9 p -68.42 173.11 5.2 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.789 -0.819 . . . . 0.6 108.789 177.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -56.17 -40.67 74.25 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.572 -0.451 . . . . 0.26 111.398 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -87.83 -22.91 24.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.581 0.705 . . . . 2.12 109.824 173.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.449 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 92.73 16.84 47.1 Favored Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 114.964 -1.016 . . . . 0.23 112.481 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -59.83 -51.8 68.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.293 0.568 . . . . 1.73 109.52 173.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -88.29 144.01 26.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.306 -0.861 . . . . 1.3 109.24 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' VAL . . . . . 0.501 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.6 p -149.3 138.12 15.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.806 0.336 . . . . 0.17 110.941 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -144.09 121.46 11.65 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.645 -0.502 . . . . 0.41 109.645 177.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 48.1 m -110.79 130.47 55.57 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 111.955 0.354 . . . . 0.15 111.955 -175.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.68 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -99.56 129.76 49.62 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.77 0 N-CA-C 108.253 -1.018 . . . . 0.12 108.253 169.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.426 ' O ' HG12 ' A' ' 45' ' ' ILE . 64.5 t -92.79 119.03 39.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 O-C-N 121.144 -0.973 . . . . 0.11 108.875 173.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.546 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -67.25 -16.47 64.3 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 112.47 0.545 . . . . 0.08 112.47 -171.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.532 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 96.8 p -71.66 -14.36 62.02 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.26 -0.644 . . . . 0.87 109.26 176.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.3 p -110.1 6.6 22.99 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.321 -0.854 . . . . 0.15 109.871 -179.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.509 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 27.9 mm -107.83 141.33 23.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.652 -0.704 . . . . 0.12 109.268 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -99.29 -45.42 5.88 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.249 -0.432 . . . . 0.52 110.449 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.522 ' C ' HD22 ' A' ' 48' ' ' LEU . 10.5 mtmm -141.86 174.05 10.94 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.372 0.606 . . . . 1.41 111.83 -175.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.768 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -137.56 152.59 49.6 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 107.261 -1.385 . . . . 0.73 107.261 174.488 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.57 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -144.05 118.95 9.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.298 0.499 . . . . 1.94 110.618 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.51 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -116.67 141.57 48.02 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 122.195 -0.316 . . . . 0.22 111.444 -178.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.425 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 81.3 p -68.74 119.78 71.39 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 115.952 -0.567 . . . . 0.26 110.753 -175.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.529 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 7.7 Cg_exo -60.56 163.43 15.45 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.646 2.231 . . . . 0.38 112.125 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.01 -21.73 66.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.707 -0.679 . . . . 0.66 111.576 -177.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.9 m -96.51 6.31 48.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.009 -0.541 . . . . 1.5 110.673 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.529 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 42.7 m -89.62 145.52 25.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.009 -0.541 . . . . 0.85 110.839 174.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -53.73 -23.39 11.57 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 114.935 -1.03 . . . . 1.77 111.666 175.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.627 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 43.2 mmtm -105.2 161.53 14.19 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 114.326 -1.306 . . . . 1.63 112.397 -164.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.435 ' HB3' ' HE3' ' A' ' 58' ' ' MET . 83.9 mmm -131.68 97.21 4.15 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.847 -1.07 . . . . 1.11 108.528 166.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.627 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.2 OUTLIER -154.14 157.37 38.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.191 0.519 . . . . 0.22 111.676 -172.99 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.7 tt -133.63 119.59 19.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.478 -0.934 . . . . 0.1 108.478 177.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.58 ' HG2' ' HB2' ' A' ' 88' ' ' MET . 8.4 mtp180 -103.88 140.88 37.06 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.219 0.533 . . . . 2.99 111.552 -178.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.98 HD21 HD13 ' A' ' 104' ' ' LEU . 1.8 mm? -115.36 111.52 20.97 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.935 -1.029 . . . . 0.13 109.599 176.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ILE . . . . . 0.556 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -91.71 98.35 8.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.354 -0.384 . . . . 0.29 110.519 -169.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.424 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -68.18 144.23 42.54 Favored Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.666 -0.697 . . . . 0.54 112.039 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.509 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 81.5 mttt . . . . . 0 C--N 1.315 -0.904 0 N-CA-C 113.213 0.82 . . . . 0.55 113.213 -173.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.728 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 22.7 t70 . . . . . 0 C--O 1.214 -0.784 0 N-CA-C 109.175 -0.676 . . . . 3.23 109.175 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -62.8 -6.71 3.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.621 0.6 . . . . 2.39 112.621 -170.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -77.07 -4.08 42.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.069 0.462 . . . . 2.96 110.757 172.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.728 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.0 ptmt -82.2 41.93 0.71 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.852 -0.613 . . . . 2.49 110.326 175.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.577 ' HE2' ' OE1' ' A' ' 79' ' ' GLU . 23.5 mmtm -44.49 115.11 0.79 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.594 -0.73 . . . . 3.4 110.437 -176.295 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.665 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 77.7 ttt180 -95.68 165.87 12.1 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 107.708 -1.219 . . . . 3.8 107.708 -176.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -128.6 131.95 48.16 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 118.904 0.775 . . . . 4.29 111.215 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -73.21 172.14 11.68 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.449 -1.25 . . . . 4.41 110.236 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -51.79 -31.54 27.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.955 0.407 . . . . 5.34 111.405 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -94.18 15.87 16.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.38 -0.373 . . . . 5.38 111.694 -176.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.51 11.77 80.18 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.348 -0.387 . . . . 4.37 113.016 176.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -73.51 131.9 42.28 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.244 -0.651 . . . . 4.51 109.244 176.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLU . . . . . 0.577 ' OE1' ' HE2' ' A' ' 71' ' ' LYS . 26.8 tt0 -68.09 95.28 0.55 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.61 -0.515 . . . . 4.28 109.61 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' VAL . . . . . 0.665 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 10.8 m -102.5 99.46 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 CA-C-O 121.732 0.777 . . . . 3.1 109.277 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.532 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.1 p -82.61 117.76 69.58 Favored Pre-proline 0 C--N 1.308 -1.239 0 CA-C-N 115.704 -0.68 . . . . 2.5 109.776 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . 0.545 ' HG2' ' HE2' ' A' ' 70' ' ' LYS . 52.9 Cg_exo . . . . . 0 CA--C 1.511 -0.653 0 C-N-CA 123.282 2.655 . . . . 1.87 112.725 -174.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' HIS . . . . . 0.58 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 58.2 m-70 . . . . . 0 C--O 1.218 -0.58 0 N-CA-C 108.598 -0.89 . . . . 0.72 108.598 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.58 ' HB2' ' HG2' ' A' ' 61' ' ' ARG . 20.1 ttm -108.4 122.1 46.3 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 119.736 -0.786 . . . . 0.27 111.654 -175.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.453 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 5.9 m-85 -112.08 130.75 55.78 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.035 -0.984 . . . . 0.27 109.65 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . 0.576 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -80.99 151.6 28.39 Favored 'General case' 0 C--N 1.316 -0.886 0 O-C-N 122.035 -0.415 . . . . 1.26 110.526 177.122 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -133.52 174.39 10.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.231 -0.441 . . . . 0.32 111.149 -175.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -115.71 -22.16 9.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.547 -0.751 . . . . 2.38 111.032 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -141.37 142.29 33.78 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.969 0.414 . . . . 1.1 110.528 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ARG . . . . . 0.655 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.0 mmm180 -67.61 -33.22 74.54 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.581 -0.736 . . . . 3.09 111.326 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.6 m -59.9 -38.75 83.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.17 -0.468 . . . . 0.35 110.512 -175.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.573 ' O ' HG12 ' A' ' 100' ' ' ILE . 6.6 t -67.71 -56.06 14.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.19 -0.459 . . . . 0.23 109.952 177.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' MET . . . . . 0.655 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.4 ptp -60.12 -41.09 91.88 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.422 -0.354 . . . . 0.17 111.2 -177.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . 0.463 ' N ' ' HG3' ' A' ' 97' ' ' MET . 24.6 t70 -61.96 -39.04 90.78 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 120.0 -0.68 . . . . 0.34 110.534 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.7 m-80 -72.96 -43.92 61.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.38 -0.373 . . . . 1.36 111.393 179.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.613 HG22 HD11 ' A' ' 104' ' ' LEU . 33.2 mm -60.49 -56.02 20.51 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 N-CA-C 108.703 -0.851 . . . . 0.12 108.703 176.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.911 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.4 ttpt -52.43 -48.35 65.81 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 115.403 -0.817 . . . . 0.79 109.836 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.695 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 32.3 ttp -47.56 -59.47 3.23 Favored 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 123.812 0.695 . . . . 0.28 111.099 176.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . 0.78 ' O ' HG13 ' A' ' 107' ' ' ILE . 24.3 m -56.41 -50.43 71.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.939 -0.573 . . . . 0.18 110.227 -178.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.98 HD13 HD21 ' A' ' 62' ' ' LEU . 25.8 mt -49.0 -56.15 9.82 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 121.342 0.591 . . . . 0.09 110.232 175.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.768 ' HG2' HD23 ' A' ' 48' ' ' LEU . 94.0 mt-30 -52.18 -43.12 64.0 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.778 -1.101 . . . . 1.2 112.177 176.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' A' ' 102' ' ' MET . 22.2 mt-30 -66.07 -38.95 89.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 122.035 0.922 . . . . 2.37 109.013 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ILE . . . . . 0.78 HG13 ' O ' ' A' ' 103' ' ' THR . 7.8 mt -72.73 -45.57 56.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 114.196 -1.365 . . . . 0.15 111.531 -177.476 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ILE . . . . . 0.591 HG13 ' O ' ' A' ' 104' ' ' LEU . 19.1 mt -58.67 -44.07 89.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 112.226 0.454 . . . . 0.19 112.226 -176.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' SER . . . . . 0.65 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 12.6 t -66.49 -15.69 63.56 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.776 -0.37 . . . . 1.14 111.865 -176.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -59.42 -35.5 74.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.619 0.723 . . . . 1.64 109.129 168.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.532 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 33.7 m-85 -97.14 -16.93 20.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.905 -1.043 . . . . 0.65 110.61 -177.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LYS . . . . . 0.65 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 9.1 mmpt? . . . . . 0 C--N 1.329 -0.307 0 N-CA-C 109.155 -0.684 . . . . 0.76 109.155 172.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo . . . . . 0 N--CA 1.478 0.593 0 N-CA-C 110.604 -0.575 . . . . 1.89 110.604 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.2 t -69.89 -32.39 70.71 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.239 -0.437 . . . . 2.05 111.189 -175.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.564 ' HA ' HD12 ' A' ' 18' ' ' ILE . 76.5 m80 69.06 -10.81 0.49 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.224 0.609 . . . . 0.75 112.217 -179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.1 p -147.77 161.59 40.94 Favored 'General case' 0 C--N 1.314 -0.946 0 C-N-CA 119.807 -0.757 . . . . 1.09 112.212 -177.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.45 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -177.82 -166.21 34.01 Favored Glycine 0 N--CA 1.44 -1.063 0 CA-C-N 114.803 -1.089 . . . . 0.16 110.413 -178.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.16 132.98 44.08 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 117.432 0.616 . . . . 0.16 110.241 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.482 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -144.58 145.51 31.84 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.952 0.406 . . . . 0.11 111.578 -176.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.468 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 84.4 mt -110.84 111.05 34.5 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 116.26 -0.427 . . . . 0.33 110.246 178.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -112.51 137.33 50.89 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.714 -0.847 . . . . 0.36 108.714 -178.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 57.1 23.28 8.31 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.966 0.412 . . . . 0.8 110.479 -177.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt 68.6 6.48 5.48 Favored 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 115.237 -0.892 . . . . 2.11 112.741 -179.155 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.401 HG13 ' CH2' ' A' ' 29' ' ' TRP . 1.5 p -94.04 122.16 45.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 108.025 -1.102 . . . . 0.22 108.025 166.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.9 p -76.21 142.49 41.47 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.896 0.379 . . . . 1.07 111.293 -173.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.463 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -160.72 -157.72 8.88 Favored Glycine 0 N--CA 1.437 -1.282 0 C-N-CA 120.325 -0.941 . . . . 0.11 113.083 -179.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 24.6 mm -126.66 135.58 63.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.095 -0.706 . . . . 0.13 109.095 -178.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.532 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.27 135.84 40.26 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.972 -0.381 . . . . 0.13 109.972 -176.428 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.98 126.71 25.5 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.846 0.355 . . . . 0.1 111.642 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.564 HD12 ' HA ' ' A' ' 3' ' ' HIS . 71.0 mt -85.24 134.38 27.23 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-O 121.023 0.439 . . . . 0.27 109.988 177.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -105.49 102.22 11.7 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.806 -0.633 . . . . 1.24 110.847 -175.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 23.9 mt-10 -116.66 169.68 9.17 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.166 -0.679 . . . . 1.2 109.166 174.625 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.441 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 26.6 t0 77.5 -1.32 2.71 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.474 1.131 . . . . 0.58 109.513 -175.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.618 HG23 ' O ' ' A' ' 23' ' ' SER . 30.0 m -104.56 -174.67 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.036 0 CA-C-N 113.762 -1.563 . . . . 0.25 109.766 178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.618 ' O ' HG23 ' A' ' 22' ' ' VAL . 43.1 m -73.59 169.46 18.34 Favored Pre-proline 0 C--N 1.318 -0.765 0 N-CA-C 105.46 -2.052 . . . . 1.13 105.46 174.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_exo -41.77 128.62 3.83 Favored 'Trans proline' 0 C--N 1.359 1.08 0 CA-C-N 121.624 1.616 . . . . 0.16 112.095 -143.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.483 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -55.77 143.1 32.17 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 114.194 -1.367 . . . . 0.1 112.198 -161.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -125.99 167.83 14.77 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 114.715 -1.129 . . . . 0.32 111.92 -170.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.66 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -118.09 107.86 14.51 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.627 -1.249 . . . . 0.09 107.627 175.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.0 m -102.97 106.5 17.04 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 120.772 0.32 . . . . 0.17 110.875 -175.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.401 ' CH2' HG13 ' A' ' 12' ' ' VAL . 84.4 t90 -87.16 131.8 34.06 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 108.888 -0.782 . . . . 0.14 108.888 171.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.466 ' HG2' HG23 ' A' ' 37' ' ' VAL . 60.0 mtt180 -126.36 157.88 37.31 Favored 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 108.918 -0.771 . . . . 1.91 108.918 174.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -67.12 172.79 4.26 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.184 -0.673 . . . . 0.6 109.184 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.463 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.2 p -57.59 -32.36 67.09 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.323 -0.551 . . . . 0.26 111.242 -179.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -93.58 -32.18 14.22 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.581 0.705 . . . . 2.12 109.546 172.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.443 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 99.59 17.39 26.36 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 114.921 -1.036 . . . . 0.23 112.693 177.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.82 -29.37 66.63 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-O 121.269 0.557 . . . . 1.73 109.743 175.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.4 tttt -103.1 141.2 36.24 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.536 -0.912 . . . . 1.3 108.536 173.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.466 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.0 p -149.98 140.39 16.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 C-N-CA 120.719 -0.392 . . . . 0.17 111.489 -179.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -144.47 125.45 14.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.435 . . . . 0.41 109.969 177.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 26.4 m -111.21 133.48 53.52 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 111.876 0.324 . . . . 0.15 111.876 -175.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.66 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.08 127.73 58.04 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.297 -1.001 . . . . 0.12 108.297 168.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 61.2 t -92.25 119.19 39.32 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 O-C-N 121.11 -0.994 . . . . 0.11 108.863 173.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.612 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.28 -16.58 64.01 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.433 0.531 . . . . 0.08 112.433 -170.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.557 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 92.9 p -70.03 -14.8 62.85 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.32 -0.622 . . . . 0.87 109.32 175.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.3 p -112.76 11.13 19.33 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.103 -0.953 . . . . 0.15 110.188 -178.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.544 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 26.7 mm -108.13 139.84 28.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 109.5 -0.555 . . . . 0.12 109.5 178.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -102.13 -43.83 5.62 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.194 -0.457 . . . . 0.52 110.604 -177.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 12.1 mtmm -139.58 171.75 13.79 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 121.069 0.461 . . . . 1.41 110.867 -177.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.728 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -150.31 151.95 33.71 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.383 -0.969 . . . . 0.73 108.383 178.482 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.487 ' HG3' HD11 ' A' ' 63' ' ' ILE . 2.3 mt-30 -139.02 145.98 40.3 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 109.777 -0.453 . . . . 1.94 109.777 -177.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.537 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -137.74 132.81 33.32 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 122.09 -0.381 . . . . 0.22 110.24 174.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.471 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 64.1 p -60.18 118.62 34.85 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 115.74 -0.664 . . . . 0.26 110.803 -176.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.451 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 24.6 Cg_exo -54.61 159.75 8.25 Favored 'Trans proline' 0 N--CA 1.464 -0.214 0 C-N-CA 122.776 2.318 . . . . 0.38 112.191 178.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.82 -21.27 66.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.011 -0.54 . . . . 0.66 111.007 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 4.2 p -83.42 -16.72 44.78 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.964 -0.562 . . . . 1.5 111.05 176.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.451 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 56.0 m -77.3 134.77 38.43 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.919 -0.582 . . . . 0.85 111.323 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -56.53 -32.84 65.49 Favored 'General case' 0 CA--C 1.512 -0.494 0 CA-C-N 114.999 -1.0 . . . . 1.77 110.11 172.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.459 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 35.7 mmtm -75.62 151.67 37.77 Favored 'General case' 0 N--CA 1.432 -1.35 0 CA-C-N 114.367 -1.288 . . . . 1.63 111.471 -176.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.471 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 5.3 mtp -131.31 98.76 4.63 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.257 -0.883 . . . . 1.11 109.454 169.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.462 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.3 OUTLIER -158.02 158.06 34.13 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.485 -0.78 . . . . 0.22 111.38 -171.613 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.567 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -133.31 119.6 19.96 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.873 -1.058 . . . . 0.1 108.2 176.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.591 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.8 mtp180 -103.13 145.68 29.55 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.273 0.559 . . . . 2.99 111.476 -178.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.947 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -127.76 107.37 9.83 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 114.919 -1.037 . . . . 0.13 108.992 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.554 HG13 ' HG2' ' A' ' 86' ' ' ARG . 2.3 mp -88.49 103.8 14.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 120.745 0.307 . . . . 0.29 110.826 -171.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.446 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -67.01 144.08 44.34 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.107 -0.497 . . . . 0.54 112.164 178.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.544 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 84.6 mttt -66.51 124.79 23.77 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 112.488 0.551 . . . . 0.55 112.488 -176.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.633 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.3 t -119.42 132.73 68.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 115.239 -0.891 . . . . 1.73 110.415 173.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.859 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 10.4 t70 -81.98 105.02 12.76 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 114.319 -1.31 . . . . 3.23 109.107 174.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -87.52 -2.62 58.74 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 112.021 0.378 . . . . 2.39 112.021 -175.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.2 p -68.76 -18.24 64.18 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.573 0.701 . . . . 2.96 109.612 175.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.859 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 2.7 ptpp? -84.16 35.3 0.53 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.196 -0.911 . . . . 2.49 110.943 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -45.16 115.07 0.83 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.413 0.625 . . . . 3.4 110.139 -176.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.55 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 78.1 ttt180 -90.48 159.25 16.62 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.884 -1.053 . . . . 3.8 108.664 -171.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 27.8 mtpt -124.74 131.34 53.46 Favored 'General case' 0 C--N 1.316 -0.858 0 C-N-CA 119.824 -0.75 . . . . 4.29 110.637 174.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.9 167.5 4.66 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 114.765 -1.107 . . . . 4.41 110.692 177.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -55.15 -32.86 62.44 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.756 0.312 . . . . 5.34 111.31 -177.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.516 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 12.9 mm-40 -86.98 11.98 12.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.962 0.411 . . . . 5.38 111.537 179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 71.17 32.0 65.95 Favored Glycine 0 N--CA 1.452 -0.287 0 CA-C-N 115.972 -0.558 . . . . 4.37 113.051 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.516 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 60.9 m-80 -89.52 130.61 35.82 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.23 -0.656 . . . . 4.51 109.23 174.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -64.51 104.2 0.76 Allowed 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.569 -0.53 . . . . 4.28 109.569 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.55 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 7.4 m -120.63 97.91 5.56 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 122.022 0.915 . . . . 3.1 109.518 179.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.446 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 p -90.42 126.71 55.55 Favored Pre-proline 0 C--N 1.31 -1.13 0 CA-C-N 115.339 -0.846 . . . . 2.5 110.195 -175.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.45 ' HG2' ' CD ' ' A' ' 70' ' ' LYS . 78.4 Cg_exo -53.43 136.03 62.37 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.993 2.462 . . . . 1.87 112.449 -176.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.456 ' HD3' ' N ' ' A' ' 83' ' ' LYS . 2.4 mppt? -95.44 146.09 30.7 Favored Pre-proline 0 C--N 1.314 -0.961 0 CA-C-N 115.552 -0.749 . . . . 2.74 109.108 178.145 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.633 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 23.5 Cg_exo -59.35 144.3 99.45 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.342 2.028 . . . . 0.84 111.272 179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -86.81 115.28 24.13 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.683 0.754 . . . . 1.57 109.826 -174.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.554 ' HG2' HG13 ' A' ' 63' ' ' ILE . 61.2 mtt180 -104.07 125.71 50.62 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 114.959 -1.019 . . . . 2.52 111.172 -170.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.556 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 82.0 m-70 -93.43 144.85 24.95 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 107.088 -1.449 . . . . 0.72 107.088 178.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.591 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 19.9 ttm -140.99 124.21 16.52 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 118.904 0.775 . . . . 0.27 111.067 176.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.482 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.4 m-85 -113.94 128.17 56.28 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.227 -0.897 . . . . 0.27 109.641 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.468 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -80.4 152.27 28.94 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.925 -0.398 . . . . 1.26 109.925 177.732 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.453 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 19.9 m-85 -133.55 171.94 13.42 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.298 0.571 . . . . 0.32 111.835 -173.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 14.6 p30 -122.73 -8.03 8.48 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.035 -0.984 . . . . 2.38 110.894 177.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 36.9 m-80 -146.01 128.31 15.81 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.213 0.53 . . . . 1.1 110.777 -176.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.443 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 8.6 mmm180 -63.24 -38.58 91.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.105 -0.952 . . . . 3.09 112.183 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.419 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 86.8 m -60.98 -36.3 79.09 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.816 0.341 . . . . 0.35 110.739 -178.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.617 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.0 t -67.41 -55.17 18.34 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.367 -0.379 . . . . 0.23 110.471 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.567 ' HA ' HD12 ' A' ' 60' ' ' LEU . 12.3 ptp -60.39 -36.54 78.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.282 -0.417 . . . . 0.17 111.128 -176.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.447 ' O ' ' HB2' ' A' ' 102' ' ' MET . 23.2 t70 -66.96 -42.96 84.29 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.544 -0.463 . . . . 0.34 110.132 177.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.454 ' O ' ' HB3' ' A' ' 102' ' ' MET . 1.5 t-20 -67.2 -44.95 78.33 Favored 'General case' 0 C--N 1.33 -0.261 0 O-C-N 123.437 0.46 . . . . 1.36 111.185 -179.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.617 HG12 ' O ' ' A' ' 96' ' ' VAL . 33.6 mm -61.44 -56.36 18.32 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 109.412 -0.588 . . . . 0.12 109.412 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.871 ' HA ' HD12 ' A' ' 104' ' ' LEU . 18.9 ttpp -52.72 -44.57 66.44 Favored 'General case' 0 C--O 1.216 -0.678 0 O-C-N 123.529 0.518 . . . . 0.79 110.028 177.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.516 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 40.1 ttp -51.34 -54.17 28.93 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.075 -0.966 . . . . 0.28 111.24 178.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.754 ' O ' HG13 ' A' ' 107' ' ' ILE . 99.0 m -62.94 -51.31 67.41 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.419 -0.355 . . . . 0.18 110.877 178.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.947 HD13 HD21 ' A' ' 62' ' ' LEU . 29.5 mt -46.68 -53.52 11.51 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 121.728 0.775 . . . . 0.09 110.514 175.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.6 ' CG ' HD13 ' A' ' 48' ' ' LEU . 23.0 mt-30 -54.84 -41.96 71.36 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.366 -1.288 . . . . 1.2 112.345 177.105 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.516 ' HG2' ' O ' ' A' ' 102' ' ' MET . 14.7 mm100 -64.19 -33.65 76.29 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.915 0.864 . . . . 2.37 109.841 178.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.754 HG13 ' O ' ' A' ' 103' ' ' THR . 14.9 mt -76.59 -46.16 31.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 CA-C-N 114.25 -1.341 . . . . 0.15 111.426 -177.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.728 HD12 HD11 ' A' ' 48' ' ' LEU . 8.8 mt -62.31 -41.39 91.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.312 -0.404 . . . . 0.19 111.976 -176.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.427 ' HA ' ' HB2' ' A' ' 112' ' ' LYS . 33.1 t -57.79 -25.58 60.75 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.711 0.291 . . . . 1.14 111.028 -177.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 76.9 mtt180 -64.78 -39.8 94.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.368 0.604 . . . . 1.64 109.879 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.557 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 32.5 m-85 -93.84 -10.17 34.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.545 -0.752 . . . . 0.65 110.193 -179.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.427 ' HB2' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER -71.46 -34.73 70.48 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.523 -0.917 . . . . 0.76 108.523 174.627 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -74.03 -39.89 63.26 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 115.325 -0.852 . . . . 2.27 109.577 172.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -90.47 49.46 1.68 Allowed 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.115 -0.948 . . . . 1.2 110.731 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.1 t70 . . . . . 0 C--O 1.248 0.978 0 CA-C-N 115.456 -0.793 . . . . 2.72 110.656 -179.161 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.711 0 N-CA-C 112.071 -0.411 . . . . 19.89 112.071 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 24.7 t 55.22 76.08 0.54 Allowed Pre-proline 0 C--O 1.234 0.261 0 C-N-CA 122.82 0.448 . . . . 18.33 111.077 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -64.37 -25.27 63.93 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.785 2.323 . . . . 17.39 112.408 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -118.63 157.75 15.1 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.867 -0.682 . . . . 16.36 111.648 178.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 44.2 p90 -162.66 133.8 3.71 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-O 120.869 0.366 . . . . 16.0 110.503 -179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -79.39 -158.4 0.09 OUTLIER 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.97 2.447 . . . . 13.15 112.271 177.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 -59.21 -56.51 21.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.51 -0.314 . . . . 12.36 111.085 -179.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 169.13 95.31 0.1 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 119.936 -1.126 . . . . 9.63 113.117 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.6 29.54 6.23 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.407 0.623 . . . . 8.34 110.311 173.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 99.1 mt -67.81 -8.7 38.16 Favored 'General case' 0 N--CA 1.441 -0.901 0 CA-C-N 115.382 -0.826 . . . . 10.41 111.88 -176.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . 0.401 ' HB3' ' OE2' ' B' ' 532' ' ' GLU . 29.4 t -99.13 -49.99 4.31 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.085 -0.507 . . . . 7.62 109.633 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 99.45 11.35 44.99 Favored Glycine 0 N--CA 1.448 -0.555 0 C-N-CA 120.86 -0.686 . . . . 5.19 112.473 173.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -114.89 -4.88 12.58 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.784 0.802 . . . . 5.5 109.331 -176.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . 0.401 ' OE2' ' HB3' ' B' ' 529' ' ' SER . 48.5 mp0 -74.09 -13.43 60.83 Favored 'General case' 0 N--CA 1.438 -1.043 0 CA-C-N 114.477 -1.238 . . . . 5.68 110.365 179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -86.9 -11.0 51.99 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 113.69 -1.596 . . . . 3.22 110.338 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -77.47 -3.01 38.25 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-O 121.229 0.537 . . . . 4.27 110.498 -179.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 11.1 p -68.13 -12.63 61.23 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.745 -0.661 . . . . 1.25 109.835 174.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . 0.523 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 79.5 p -74.46 -33.85 63.01 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.549 -0.751 . . . . 2.08 110.053 175.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 27.5 mm -80.72 -37.65 16.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.883 -0.599 . . . . 1.29 110.059 175.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -73.43 1.02 10.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.772 0.796 . . . . 0.76 110.533 175.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.523 ' HB3' ' O ' ' B' ' 536' ' ' SER . 14.1 t70 -84.84 -44.74 12.96 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.796 -1.093 . . . . 1.23 109.431 172.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 13.9 tmm? -59.13 -39.53 82.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.003 -0.999 . . . . 2.29 109.113 174.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 3.6 t70 -51.61 -51.23 57.29 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.909 -1.041 . . . . 1.18 110.423 175.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.406 ' CD2' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -65.57 -41.22 93.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.174 -0.921 . . . . 0.56 111.25 -174.634 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 9.1 t -60.78 -35.67 77.04 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.901 -0.59 . . . . 1.58 110.18 -179.19 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -71.9 -35.34 69.7 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.932 -0.576 . . . . 0.84 111.061 177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 94.7 mt -65.58 -44.47 86.57 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.028 -0.533 . . . . 1.08 111.875 -176.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . 0.414 HD11 ' HB3' ' A' ' 49' ' ' GLN . 48.0 mt -69.67 -25.94 64.14 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.219 0.533 . . . . 0.97 110.398 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 50.8 p -90.14 13.49 14.95 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.656 -0.702 . . . . 1.42 111.554 178.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -78.21 -1.32 32.26 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.66 0.266 . . . . 2.67 110.69 176.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 65.7 mt 71.87 -62.75 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-N 115.493 -0.776 . . . . 5.23 110.314 -177.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.9 m -69.57 139.14 53.68 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 109.761 -0.459 . . . . 6.4 109.761 175.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . 0.437 ' HA ' ' HB3' ' A' ' 52' ' ' PRO . 39.8 m . . . . . 0 C--O 1.248 0.984 0 CA-C-O 118.649 -0.691 . . . . 7.59 110.505 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_exo . . . . . 0 N--CA 1.479 0.63 0 N-CA-C 110.849 -0.481 . . . . 1.89 110.849 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.404 ' O ' ' HB2' ' A' ' 3' ' ' HIS . 38.4 t -69.16 -32.73 72.26 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.957 -0.565 . . . . 2.05 110.735 -178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.406 ' CD2' HG21 ' A' ' 103' ' ' THR . 68.6 m80 70.44 -12.45 0.52 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.881 0.696 . . . . 0.75 112.881 177.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 p -146.53 167.24 24.2 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.647 0.737 . . . . 1.09 112.962 -172.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.49 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 176.01 -165.97 36.86 Favored Glycine 0 N--CA 1.445 -0.761 0 CA-C-N 114.511 -1.222 . . . . 0.16 110.049 -179.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.81 135.69 38.42 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 118.017 0.908 . . . . 0.16 110.461 178.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.54 146.71 32.51 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.014 0.435 . . . . 0.11 111.111 -179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.569 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 52.2 mt -110.38 111.06 34.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 115.911 -0.586 . . . . 0.33 110.054 179.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -112.57 132.32 55.18 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 108.598 -0.89 . . . . 0.36 108.598 -178.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 58.51 25.2 12.76 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 120.962 0.411 . . . . 0.8 110.539 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 21.7 mtpt 68.98 4.12 4.36 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.551 -0.75 . . . . 2.11 112.901 179.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.404 ' O ' ' HZ2' ' A' ' 29' ' ' TRP . 1.2 p -92.37 115.25 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.553 0 N-CA-C 107.697 -1.224 . . . . 0.22 107.697 166.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 14.0 m -71.92 145.75 48.28 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.057 -0.52 . . . . 1.07 110.82 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.73 -158.76 10.57 Favored Glycine 0 N--CA 1.433 -1.538 0 C-N-CA 119.914 -1.136 . . . . 0.11 113.196 -177.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.7 mm -126.18 132.03 70.95 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 N-CA-C 109.336 -0.616 . . . . 0.13 109.336 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.502 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -100.49 134.93 38.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 109.721 -0.474 . . . . 0.13 109.721 -177.559 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.11 128.18 27.7 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.416 -0.356 . . . . 0.1 111.054 -179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.2 mt -85.1 138.07 19.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-O 121.387 0.613 . . . . 0.27 109.932 175.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.3 t30 -106.93 99.4 8.97 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 114.808 -1.087 . . . . 1.24 110.299 -176.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -113.97 169.71 8.8 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.317 -0.623 . . . . 1.2 109.317 176.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 14.2 t70 76.16 -2.1 2.81 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 122.107 0.956 . . . . 0.58 109.857 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.629 HG23 ' O ' ' A' ' 23' ' ' SER . 34.6 m -103.2 -173.59 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 114.156 -1.384 . . . . 0.25 109.742 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.629 ' O ' HG23 ' A' ' 22' ' ' VAL . 28.4 m -72.68 167.31 34.57 Favored Pre-proline 0 C--N 1.318 -0.79 0 N-CA-C 105.065 -2.198 . . . . 1.13 105.065 173.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_exo -42.09 127.71 3.99 Favored 'Trans proline' 0 C--N 1.355 0.896 0 CA-C-N 121.279 1.492 . . . . 0.16 112.412 -140.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -50.53 138.57 17.34 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-N 113.942 -1.481 . . . . 0.1 112.399 -166.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -123.39 168.77 12.1 Favored 'General case' 0 N--CA 1.434 -1.261 0 CA-C-N 114.259 -1.337 . . . . 0.32 111.817 -170.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.72 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.15 106.5 13.4 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.324 -1.361 . . . . 0.09 107.324 172.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.3 m -102.52 106.22 16.89 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-O 120.887 0.375 . . . . 0.17 110.785 -176.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.404 ' HZ2' ' O ' ' A' ' 12' ' ' VAL . 81.5 t90 -85.24 132.14 34.32 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 108.781 -0.822 . . . . 0.14 108.781 172.391 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.464 ' HG2' HG23 ' A' ' 37' ' ' VAL . 57.1 mtt180 -125.84 158.27 35.46 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.023 -0.732 . . . . 1.91 109.023 174.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.2 p -69.84 175.99 3.96 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 109.305 -0.628 . . . . 0.6 109.305 178.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 p -59.89 -38.3 81.85 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 120.231 -0.588 . . . . 0.26 111.034 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -85.0 -29.89 24.63 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.776 0.798 . . . . 2.12 109.36 171.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.426 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 94.66 16.41 42.56 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 114.737 -1.12 . . . . 0.23 112.331 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -69.11 -40.07 78.57 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.433 -0.58 . . . . 1.73 109.433 176.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -87.89 139.42 30.53 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.799 -0.815 . . . . 1.3 108.799 171.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.464 HG23 ' HG2' ' A' ' 30' ' ' ARG . 13.6 p -149.1 137.86 15.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-O 120.811 0.338 . . . . 0.17 110.828 -179.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -144.5 123.16 12.54 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.756 -0.461 . . . . 0.41 109.756 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 49.2 m -112.81 131.94 55.48 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 112.732 0.641 . . . . 0.15 112.732 -174.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.72 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -99.31 131.03 47.38 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.597 0 N-CA-C 108.035 -1.098 . . . . 0.12 108.035 168.259 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.418 ' O ' HG12 ' A' ' 45' ' ' ILE . 63.9 t -93.86 121.38 44.46 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 O-C-N 121.122 -0.986 . . . . 0.11 108.843 171.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.61 -19.77 64.46 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.157 0.799 . . . . 0.08 113.157 -169.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.3 p -69.43 -14.44 62.89 Favored 'General case' 0 C--N 1.32 -0.695 0 C-N-CA 120.05 -0.66 . . . . 0.87 109.681 175.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.1 p -109.62 10.54 24.96 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.599 -0.728 . . . . 0.15 110.076 -178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.533 HG21 ' CD1' ' A' ' 62' ' ' LEU . 24.6 mm -111.48 141.09 27.94 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 108.871 -0.788 . . . . 0.12 108.871 178.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -106.91 -43.67 4.6 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.908 0.385 . . . . 0.52 110.636 -177.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.455 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 1.0 OUTLIER -134.31 165.81 24.27 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.042 -0.526 . . . . 1.41 110.744 -174.822 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.78 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -150.32 132.35 15.26 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.706 -0.85 . . . . 0.73 108.706 177.816 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -134.91 123.11 22.9 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.969 -0.382 . . . . 1.94 109.969 -172.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -115.93 143.15 45.83 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.321 0.509 . . . . 0.22 110.907 -179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.622 HG21 ' HB3' ' A' ' 57' ' ' LYS . 62.0 p -61.73 120.78 59.72 Favored Pre-proline 0 C--O 1.233 0.224 0 CA-C-N 115.884 -0.598 . . . . 0.26 110.859 -177.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.423 ' HD2' ' HB3' ' A' ' 55' ' ' SER . 24.6 Cg_exo -55.29 157.11 15.0 Favored 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 122.556 2.17 . . . . 0.38 111.445 178.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.23 -9.03 14.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.854 0.359 . . . . 0.66 111.854 -177.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.9 p -104.76 -9.46 18.1 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 1.5 111.829 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.596 ' OG ' ' HB ' ' A' ' 51' ' ' THR . 89.5 p -64.83 151.89 44.27 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.062 0.458 . . . . 0.85 111.092 -178.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.502 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 65.4 mt-10 -59.2 -22.7 61.43 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.823 0.82 . . . . 1.77 110.231 171.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.622 ' HB3' HG21 ' A' ' 51' ' ' THR . 9.9 mptt -101.43 169.42 8.88 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-N 114.27 -1.332 . . . . 1.63 112.838 -170.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.448 ' O ' ' HG3' ' A' ' 59' ' ' MET . 65.7 mmm -141.44 98.34 3.34 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.474 -1.239 . . . . 1.11 108.109 165.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.455 ' CE ' ' HG2' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -157.52 160.31 38.09 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.685 -0.689 . . . . 0.22 111.346 -169.733 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.536 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -131.99 120.38 22.37 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.046 -0.979 . . . . 0.1 108.481 176.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.531 HH22 ' HB2' ' B' ' 539' ' ' ASP . 3.6 mmt85 -99.95 131.62 45.8 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 120.992 0.425 . . . . 2.99 110.37 -179.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.943 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -112.84 106.44 14.76 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.563 -0.744 . . . . 0.13 109.0 175.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 4.7 mp -92.32 105.7 16.97 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.069 0 CA-C-O 120.955 0.407 . . . . 0.29 111.163 -171.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.533 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -63.04 164.36 28.29 Favored Glycine 0 N--CA 1.445 -0.75 0 CA-C-N 115.356 -0.838 . . . . 0.54 112.626 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.404 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.7 mttt -81.72 120.09 24.68 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 121.567 0.699 . . . . 0.55 112.567 -176.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.624 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.4 t -120.7 138.48 51.03 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 114.555 -1.202 . . . . 1.73 109.471 170.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.803 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 22.1 t70 -87.38 84.86 7.13 Favored 'General case' 0 C--N 1.31 -1.125 0 N-CA-C 109.292 -0.632 . . . . 3.23 109.292 178.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -67.4 -2.65 6.58 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 112.109 0.411 . . . . 2.39 112.109 -172.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.9 p -80.18 -0.99 38.49 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.934 0.397 . . . . 2.96 110.716 171.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.803 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.4 ptpt -86.85 39.05 0.83 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.112 -0.495 . . . . 2.49 110.154 173.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.532 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 24.7 mmtm -43.71 113.81 0.56 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.982 -0.554 . . . . 3.4 110.366 -175.022 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.649 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 56.8 ttt180 -90.71 161.53 15.31 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 108.075 -1.083 . . . . 3.8 108.075 -175.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 95.7 mttt -135.29 144.97 47.06 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 118.188 0.449 . . . . 4.29 110.053 175.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.453 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER -78.88 179.92 6.98 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.933 -0.576 . . . . 4.41 109.559 178.256 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -56.33 -29.76 61.73 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 111.913 0.338 . . . . 5.34 111.913 -178.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.453 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 17.6 mt-10 -81.22 -40.83 23.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.855 0.359 . . . . 5.38 110.83 -178.638 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 129.22 15.47 2.05 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.427 -0.892 . . . . 4.37 112.835 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.538 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 41.0 m-80 -74.04 132.07 41.98 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.664 -0.495 . . . . 4.51 109.664 178.246 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -74.48 92.93 2.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.127 0.489 . . . . 4.28 110.028 -178.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.649 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 7.5 m -102.65 99.46 8.44 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.833 0.825 . . . . 3.1 109.227 -179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.532 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.6 OUTLIER -88.85 125.57 62.25 Favored Pre-proline 0 C--N 1.312 -1.051 0 CA-C-N 115.886 -0.597 . . . . 2.5 110.492 -176.279 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -59.76 140.06 91.52 Favored 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.852 2.368 . . . . 1.87 111.998 179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.44 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -94.91 144.02 27.13 Favored Pre-proline 0 C--N 1.314 -0.964 0 CA-C-N 115.672 -0.694 . . . . 2.74 109.501 178.71 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.624 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 24.6 Cg_exo -60.51 150.72 79.87 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 122.76 2.307 . . . . 0.84 111.135 178.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -81.06 113.79 19.49 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.296 0.57 . . . . 1.57 109.547 -175.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 63' ' ' ILE . 87.5 mtt180 -101.3 115.82 31.39 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.498 -0.774 . . . . 2.52 110.535 -172.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.471 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 40.3 m-70 -94.56 112.04 23.8 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 115.258 -0.883 . . . . 0.72 109.348 -173.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.525 ' CB ' ' HD3' ' A' ' 61' ' ' ARG . 23.2 ttm -101.92 132.82 47.49 Favored 'General case' 0 C--N 1.319 -0.732 0 C-N-CA 120.374 -0.53 . . . . 0.27 111.261 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 -121.66 129.64 52.92 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 109.252 -0.648 . . . . 0.27 109.252 171.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.569 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -80.69 153.6 27.79 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 120.943 0.401 . . . . 1.26 110.186 176.687 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.499 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 21.2 m-85 -135.75 166.07 24.12 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 121.298 0.571 . . . . 0.32 111.195 -175.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 9.4 t30 -114.61 -19.32 11.16 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.198 -0.91 . . . . 2.38 109.869 176.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.549 ' HB2' HG23 ' A' ' 96' ' ' VAL . 18.7 m120 -134.89 123.66 23.79 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.884 -0.598 . . . . 1.1 110.788 -174.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.53 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 14.6 mmm180 -63.04 -34.25 77.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.337 -0.847 . . . . 3.09 112.236 -179.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 24.4 m -62.16 -34.62 76.74 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.955 0.407 . . . . 0.35 110.777 -178.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.571 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.2 t -70.13 -58.01 6.58 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.434 0 CA-C-N 116.03 -0.532 . . . . 0.23 110.265 179.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.536 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.3 ptp -55.32 -38.42 68.69 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.15 -0.477 . . . . 0.17 111.052 -177.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.429 ' N ' ' HG3' ' A' ' 97' ' ' MET . 30.1 t70 -63.9 -45.65 88.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.647 0.261 . . . . 0.34 110.448 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -71.69 -35.25 70.2 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.088 -0.505 . . . . 1.36 111.887 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.663 HG22 HD11 ' A' ' 104' ' ' LEU . 28.2 mm -66.95 -57.47 9.89 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.38 0 N-CA-C 108.472 -0.936 . . . . 0.12 108.472 175.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.773 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.7 ttpt -48.0 -50.39 27.7 Favored 'General case' 0 C--O 1.219 -0.522 0 O-C-N 124.223 0.952 . . . . 0.79 109.899 176.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.693 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 48.1 ttp -48.19 -57.55 5.75 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.227 -0.897 . . . . 0.28 111.2 177.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.729 ' O ' HG13 ' A' ' 107' ' ' ILE . 45.1 m -58.45 -53.77 54.58 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.413 -0.358 . . . . 0.18 110.73 -179.668 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.943 HD13 HD21 ' A' ' 62' ' ' LEU . 22.7 mt -47.21 -53.77 12.39 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.492 0.663 . . . . 0.09 110.561 176.054 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.661 ' CG ' HD13 ' A' ' 48' ' ' LEU . 22.8 mt-30 -53.66 -42.04 67.45 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 114.611 -1.177 . . . . 1.2 112.372 176.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.693 ' HG3' ' O ' ' A' ' 102' ' ' MET . 36.8 mt-30 -66.03 -31.65 72.67 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.782 0.801 . . . . 2.37 109.194 179.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.729 HG13 ' O ' ' A' ' 103' ' ' THR . 15.0 mt -77.35 -45.1 29.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 114.597 -1.183 . . . . 0.15 111.289 -177.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.78 HD12 HD11 ' A' ' 48' ' ' LEU . 9.8 mt -65.24 -38.45 82.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.166 -0.47 . . . . 0.19 112.177 -175.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.401 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 3.8 p -59.54 -26.49 65.39 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.878 0.37 . . . . 1.14 110.986 -179.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 90.9 mtt180 -60.63 -50.58 72.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.79 0.805 . . . . 1.64 109.478 173.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.652 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 9.3 m-85 -89.96 28.31 1.4 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.71 -1.132 . . . . 0.65 110.1 177.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 112' ' ' LYS . 0.0 OUTLIER -117.47 -40.26 3.08 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.036 -1.098 . . . . 0.76 108.036 174.24 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -65.58 -29.98 70.65 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.128 -0.942 . . . . 2.27 109.117 166.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -113.29 62.69 0.64 Allowed 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 114.943 -1.026 . . . . 1.2 110.057 176.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.652 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 31.3 t70 . . . . . 0 C--O 1.245 0.823 0 CA-C-O 118.243 -0.884 . . . . 2.72 110.428 -178.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.689 0 N-CA-C 112.144 -0.383 . . . . 19.89 112.144 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 32.5 m -121.56 151.05 56.24 Favored Pre-proline 0 C--N 1.324 -0.541 0 N-CA-C 109.942 -0.392 . . . . 18.33 109.942 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -77.23 47.53 2.27 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.86 2.373 . . . . 17.39 112.29 -178.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -91.55 66.8 2.28 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 115.662 -0.699 . . . . 16.36 112.375 -177.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 33.4 p90 -150.82 130.09 6.46 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-O 120.783 0.325 . . . . 16.0 110.267 176.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -81.41 -11.25 11.92 Favored 'Trans proline' 0 N--CA 1.46 -0.443 0 C-N-CA 122.675 2.25 . . . . 13.15 111.549 177.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . 0.45 ' O ' ' HB2' ' B' ' 528' ' ' LEU . 88.5 m-20 -86.4 67.91 10.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.446 -0.797 . . . . 12.36 110.544 -178.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -73.65 -5.93 70.09 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.96 -0.638 . . . . 9.63 112.102 179.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.43 ' H ' ' CD2' ' B' ' 527' ' ' LEU . 0.9 OUTLIER -103.65 14.58 30.81 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.068 0.461 . . . . 8.34 110.455 178.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . 0.45 ' HB2' ' O ' ' B' ' 525' ' ' ASN . 0.5 OUTLIER -79.37 47.64 0.83 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.905 -0.589 . . . . 10.41 110.62 -175.496 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 26.9 t 178.75 -58.59 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.098 -0.705 . . . . 7.62 109.098 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 68.06 79.52 0.25 Allowed Glycine 0 N--CA 1.446 -0.691 0 C-N-CA 120.795 -0.717 . . . . 5.19 111.651 178.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -106.19 17.17 23.89 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.924 0.869 . . . . 5.5 108.856 -173.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -82.88 -10.04 59.02 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 114.153 -1.385 . . . . 5.68 109.774 -175.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -112.78 -31.62 6.67 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 113.089 -1.869 . . . . 3.22 109.566 176.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -68.98 -17.32 63.92 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.444 -0.798 . . . . 4.27 110.845 178.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 5.3 p -64.49 -24.56 67.65 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.069 -0.514 . . . . 1.25 111.032 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 15.2 m -71.22 -35.86 71.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.993 -0.549 . . . . 2.08 110.661 177.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 23.0 mm -87.12 -31.62 6.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.052 -0.522 . . . . 1.29 110.359 177.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . 0.495 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -72.28 -1.07 13.93 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 121.653 0.739 . . . . 0.76 110.656 178.458 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.531 ' HB2' HH22 ' A' ' 61' ' ' ARG . 30.6 t70 -74.77 -38.63 62.13 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.864 -1.062 . . . . 1.23 109.239 172.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 87.3 mtp -72.86 -23.56 60.76 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.831 -1.077 . . . . 2.29 110.069 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . 0.538 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 0.2 OUTLIER -65.16 -46.91 78.93 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.431 -0.804 . . . . 1.18 110.238 174.381 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -40.98 86.22 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.523 -0.762 . . . . 0.56 112.081 -172.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -26.48 66.95 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-O 121.041 0.448 . . . . 1.58 111.281 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . 0.445 ' O ' ' HG3' ' B' ' 548' ' ' GLN . . . -85.49 -35.62 21.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.064 -0.516 . . . . 0.84 110.307 177.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.597 HD23 ' NE2' ' B' ' 548' ' ' GLN . 96.3 mt -62.5 -44.09 97.23 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.926 -0.579 . . . . 1.08 111.785 -179.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 20.6 mt -71.6 -22.88 61.66 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.548 0.69 . . . . 0.97 110.195 -179.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 32.9 m -90.67 12.62 18.45 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.027 -0.988 . . . . 1.42 111.281 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . 0.597 ' NE2' HD23 ' B' ' 545' ' ' LEU . 68.2 mt-30 -85.92 56.36 3.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.275 0.559 . . . . 2.67 112.002 -178.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . 0.485 HD13 ' H ' ' B' ' 549' ' ' ILE . 0.2 OUTLIER -118.19 22.38 5.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.503 0.668 . . . . 5.23 109.421 171.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 16.4 m -82.78 73.6 9.8 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.27 -0.877 . . . . 6.4 110.463 -178.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 8.2 t . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.604 -0.712 . . . . 7.59 109.19 179.831 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.551 ' HA ' ' OD1' ' A' ' 99' ' ' ASN . 1.2 Cg_endo . . . . . 0 N--CA 1.477 0.539 0 N-CA-C 110.718 -0.532 . . . . 1.89 110.718 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.9 p -76.58 -22.11 54.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.185 -0.461 . . . . 2.05 111.477 -176.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.558 ' CD2' HG21 ' A' ' 103' ' ' THR . 73.7 m80 64.12 -0.1 0.9 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.741 -0.663 . . . . 0.75 112.033 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.9 p -157.25 155.7 31.24 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 119.943 -0.703 . . . . 1.09 112.318 -174.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.516 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -173.76 -162.17 25.14 Favored Glycine 0 N--CA 1.439 -1.124 0 CA-C-N 114.627 -1.169 . . . . 0.16 110.438 -179.512 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -101.39 136.02 41.93 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 117.345 0.573 . . . . 0.16 110.162 179.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.5 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -147.45 141.15 25.63 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.988 0.423 . . . . 0.11 111.876 -176.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.479 HG12 ' HA ' ' A' ' 13' ' ' SER . 88.0 mt -105.58 122.26 58.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 CA-C-N 116.147 -0.479 . . . . 0.33 109.937 175.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -127.79 131.2 49.62 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.723 -0.843 . . . . 0.36 108.723 -179.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 60.28 29.62 19.16 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 122.909 0.484 . . . . 0.8 110.562 -177.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm 65.72 5.78 3.54 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.921 0.711 . . . . 2.11 112.921 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.1 p -98.49 119.91 47.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.476 -0.935 . . . . 0.22 108.476 167.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.479 ' HA ' HG12 ' A' ' 8' ' ' ILE . 52.5 p -74.34 144.71 44.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.158 -0.474 . . . . 1.07 110.904 -175.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.422 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.81 -159.57 10.26 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.258 -0.972 . . . . 0.11 113.286 -178.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 19.9 mm -125.93 134.73 65.86 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 109.107 -0.701 . . . . 0.13 109.107 -178.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.554 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.22 135.7 37.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 110.129 -0.323 . . . . 0.13 110.129 -176.572 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.59 129.03 30.21 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.985 0.421 . . . . 0.1 111.413 -179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.546 HD12 ' HA ' ' A' ' 3' ' ' HIS . 61.9 mt -85.91 135.37 25.14 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 109.763 -0.458 . . . . 0.27 109.763 176.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 28.8 t30 -108.67 103.28 12.35 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 116.096 -0.502 . . . . 1.24 111.182 -173.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.456 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 28.2 mt-10 -116.79 170.75 8.36 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.46 -0.941 . . . . 1.2 108.46 174.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.456 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.8 t70 81.07 -5.97 1.63 Allowed 'General case' 0 N--CA 1.48 1.045 0 CA-C-O 122.428 1.109 . . . . 0.58 109.361 -176.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.662 HG23 ' O ' ' A' ' 23' ' ' SER . 32.7 m -103.33 -174.17 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 CA-C-N 113.753 -1.567 . . . . 0.25 109.943 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.662 ' O ' HG23 ' A' ' 22' ' ' VAL . 57.9 m -73.14 168.67 22.75 Favored Pre-proline 0 C--N 1.313 -1.001 0 N-CA-C 105.423 -2.066 . . . . 1.13 105.423 173.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -41.31 128.13 3.16 Favored 'Trans proline' 0 C--N 1.355 0.885 0 CA-C-N 121.296 1.499 . . . . 0.16 112.642 -143.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.488 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -51.44 141.7 15.14 Favored 'General case' 0 CA--C 1.505 -0.769 0 CA-C-N 113.993 -1.458 . . . . 0.1 112.563 -165.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -124.65 168.79 12.67 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 114.228 -1.351 . . . . 0.32 111.922 -170.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -116.53 107.3 14.57 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 107.398 -1.334 . . . . 0.09 107.398 172.173 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.6 m -104.49 106.7 17.3 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 120.878 0.371 . . . . 0.17 110.894 -175.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.7 t90 -85.12 132.34 34.32 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.842 -0.799 . . . . 0.14 108.842 172.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HG2' HG23 ' A' ' 37' ' ' VAL . 62.1 mtt180 -127.29 156.97 41.09 Favored 'General case' 0 C--N 1.31 -1.122 0 N-CA-C 108.893 -0.781 . . . . 1.91 108.893 174.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -68.76 176.04 3.25 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.385 -0.598 . . . . 0.6 109.385 179.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.422 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 9.3 p -60.13 -40.79 91.02 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.162 -0.615 . . . . 0.26 110.421 178.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -76.73 -31.33 57.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.85 0.833 . . . . 2.12 109.157 170.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.458 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 89.63 15.27 58.55 Favored Glycine 0 N--CA 1.446 -0.67 0 CA-C-N 114.458 -1.247 . . . . 0.23 111.813 179.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -64.36 -53.37 49.7 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.288 -0.634 . . . . 1.73 109.288 174.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 43.0 tttt -76.76 139.28 40.36 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.328 -0.851 . . . . 1.3 108.878 174.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.5 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.4 p -149.43 138.81 15.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 120.927 0.394 . . . . 0.17 111.142 -178.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -144.18 126.21 15.45 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.751 -0.463 . . . . 0.41 109.751 178.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 30.0 m -114.7 133.22 56.05 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.396 0.517 . . . . 0.15 112.396 -173.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -101.74 130.05 52.0 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.592 0 N-CA-C 108.125 -1.065 . . . . 0.12 108.125 168.482 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.404 ' O ' HG12 ' A' ' 45' ' ' ILE . 63.3 t -93.72 121.93 44.77 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 O-C-N 121.194 -0.941 . . . . 0.11 108.801 173.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.594 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.35 -18.45 63.8 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.136 0.791 . . . . 0.08 113.136 -169.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.6 p -69.55 -15.47 63.23 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.922 -0.711 . . . . 0.87 109.562 174.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 p -109.84 12.2 24.03 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.464 -0.789 . . . . 0.15 110.013 -178.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.552 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.9 mm -111.54 138.91 38.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.991 -0.549 . . . . 0.12 109.659 178.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -100.1 -46.66 5.25 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.824 -0.625 . . . . 0.52 110.563 -177.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.493 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 18.1 mtmt -140.3 174.73 10.22 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.135 0.493 . . . . 1.41 111.442 -176.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.616 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -152.73 136.07 15.84 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.748 -0.834 . . . . 0.73 108.748 -179.35 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.557 ' HG2' HD11 ' A' ' 63' ' ' ILE . 6.8 mm100 -129.81 122.53 28.94 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 122.282 -0.261 . . . . 1.94 110.463 -175.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.455 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -116.09 140.97 48.74 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 122.052 -0.405 . . . . 0.22 111.279 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 66.6 p -66.97 119.3 63.03 Favored Pre-proline 0 C--O 1.233 0.21 0 CA-C-N 116.099 -0.5 . . . . 0.26 110.146 -177.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.459 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 26.0 Cg_exo -54.25 159.91 7.28 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 122.721 2.28 . . . . 0.38 111.556 178.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.89 -15.69 63.12 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.195 -0.457 . . . . 0.66 110.573 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 7.9 p -86.14 -16.82 36.71 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.79 -0.641 . . . . 1.5 110.595 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.459 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 47.4 m -76.79 140.7 40.81 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-N 115.845 -0.616 . . . . 0.85 111.019 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -66.56 -18.68 65.5 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.404 -0.817 . . . . 1.77 110.7 176.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.575 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 11.2 mmmm -87.05 151.14 23.5 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 114.743 -1.117 . . . . 1.63 111.031 -175.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -124.93 96.57 4.92 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 108.121 -1.066 . . . . 1.11 108.121 169.139 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.575 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.23 155.96 34.77 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.458 0.647 . . . . 0.22 111.899 -174.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.606 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -134.36 119.25 18.4 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 114.698 -1.137 . . . . 0.1 108.329 175.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.727 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 3.5 mtp180 -102.42 142.78 33.08 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.249 0.547 . . . . 2.99 111.311 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.942 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -121.53 107.81 12.87 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.036 -0.984 . . . . 0.13 109.012 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.609 HG13 ' HD2' ' A' ' 86' ' ' ARG . 1.7 mp -90.81 103.67 14.64 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.773 -0.455 . . . . 0.29 109.773 -172.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.442 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -67.54 151.89 52.39 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 121.394 -0.432 . . . . 0.54 112.885 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.498 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 83.8 mttt -70.54 159.03 35.07 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 122.655 0.382 . . . . 0.55 111.182 179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -106.35 109.43 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 CA-C-N 116.293 -0.412 . . . . 1.73 110.953 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.577 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.3 m-20 -93.62 79.11 4.29 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.993 -1.114 . . . . 3.23 107.993 169.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -66.68 -1.79 4.18 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.31 0.485 . . . . 2.39 112.31 -171.278 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.2 p -69.21 -11.26 60.65 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.35 0.595 . . . . 2.96 109.861 168.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -84.69 26.41 0.82 Allowed 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.399 -0.819 . . . . 2.49 111.382 179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.7 mtmt -47.08 113.75 0.73 Allowed 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.432 0.634 . . . . 3.4 109.332 -174.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.47 ' HB3' HG23 ' A' ' 80' ' ' VAL . 72.6 ttt180 -96.85 168.61 10.39 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 114.692 -1.14 . . . . 3.8 109.069 -167.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.551 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 63.9 mttp -133.59 141.47 47.69 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 118.104 0.411 . . . . 4.29 110.185 174.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -82.11 -168.38 1.93 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.902 -0.59 . . . . 4.41 110.695 -177.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -56.84 -31.11 64.45 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.799 0.296 . . . . 5.34 111.799 -178.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.448 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 10.6 mt-10 -86.86 -34.68 19.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.1 0.476 . . . . 5.38 110.444 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 117.94 18.36 5.15 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.478 -0.868 . . . . 4.37 112.049 -179.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.551 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 30.8 m-80 -75.39 134.8 40.86 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.993 -0.744 . . . . 4.51 108.993 177.557 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -69.02 92.68 0.53 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.982 0.42 . . . . 4.28 110.235 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.47 HG23 ' HB3' ' A' ' 72' ' ' ARG . 19.0 m -97.22 99.58 9.16 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 CA-C-O 121.677 0.751 . . . . 3.1 109.574 176.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 1.5 p -85.4 107.38 12.0 Favored Pre-proline 0 C--N 1.317 -0.844 0 N-CA-C 109.354 -0.61 . . . . 2.5 109.354 178.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -63.8 151.6 84.43 Favored 'Trans proline' 0 C--O 1.234 0.301 0 C-N-CA 123.48 2.786 . . . . 1.87 113.943 -170.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.546 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 27.3 mtmm -87.26 172.85 7.36 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 113.991 -1.459 . . . . 2.74 108.684 177.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.546 ' HD2' ' HB3' ' A' ' 83' ' ' LYS . 22.9 Cg_exo -53.39 143.98 52.0 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 121.194 1.263 . . . . 0.84 111.281 176.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -92.79 113.35 25.6 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 116.201 -0.454 . . . . 1.57 109.777 -177.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.609 ' HD2' HG13 ' A' ' 63' ' ' ILE . 0.7 OUTLIER -96.37 121.7 38.45 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 109.537 -0.542 . . . . 2.52 109.537 -176.048 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.557 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 77.8 m-70 -96.29 148.08 23.12 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 107.541 -1.281 . . . . 0.72 107.541 176.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.727 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 22.9 ttm -140.97 132.35 26.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 119.135 0.88 . . . . 0.27 111.265 173.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.5 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.6 m-85 -122.18 128.74 51.58 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.339 -0.846 . . . . 0.27 109.588 178.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.477 ' O ' ' HA ' ' A' ' 7' ' ' ALA . 0.3 OUTLIER -81.65 150.57 28.01 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.943 -0.391 . . . . 1.26 109.943 177.251 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.427 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.1 m-85 -130.13 175.73 8.67 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.965 0.412 . . . . 0.32 111.55 -173.525 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -122.57 -9.53 8.45 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.715 -0.675 . . . . 2.38 110.494 178.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.51 ' HB2' HG23 ' A' ' 96' ' ' VAL . 52.6 m-80 -146.16 136.96 24.31 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.237 -0.438 . . . . 1.1 110.087 -179.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.464 ' HD3' ' HE1' ' A' ' 58' ' ' MET . 1.2 mpp_? -70.5 -35.09 73.03 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 115.905 -0.589 . . . . 3.09 111.544 -178.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.448 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 19.5 m -61.63 -36.34 80.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.801 0.334 . . . . 0.35 110.578 -178.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.615 ' O ' HG12 ' A' ' 100' ' ' ILE . 17.5 t -64.71 -58.2 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.422 0 CA-C-N 116.203 -0.453 . . . . 0.23 110.499 178.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.606 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.0 ptp -57.59 -39.1 76.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 0.17 110.916 -177.257 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.407 ' N ' ' HG3' ' A' ' 97' ' ' MET . 19.5 t70 -65.66 -42.14 91.7 Favored 'General case' 0 C--N 1.32 -0.703 0 C-N-CA 120.641 -0.424 . . . . 0.34 110.208 177.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.551 ' OD1' ' HA ' ' A' ' 1' ' ' PRO . 1.6 t-20 -68.83 -43.97 74.42 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 123.27 0.356 . . . . 1.36 111.351 -179.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.615 HG12 ' O ' ' A' ' 96' ' ' VAL . 31.4 mm -61.8 -56.58 16.81 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.429 0 N-CA-C 108.674 -0.862 . . . . 0.12 108.674 177.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.803 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.8 ttpt -50.81 -48.6 59.67 Favored 'General case' 0 C--O 1.218 -0.605 0 O-C-N 123.9 0.75 . . . . 0.79 109.864 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.685 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 44.2 ttp -49.35 -54.82 15.28 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.387 -0.824 . . . . 0.28 111.321 177.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.696 ' O ' HG13 ' A' ' 107' ' ' ILE . 30.0 m -61.92 -51.96 66.0 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.322 -0.399 . . . . 0.18 110.592 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.942 HD13 HD21 ' A' ' 62' ' ' LEU . 29.2 mt -46.48 -54.7 8.74 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 115.835 -0.62 . . . . 0.09 110.17 174.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.558 ' CG ' HD13 ' A' ' 48' ' ' LEU . 90.8 mt-30 -52.17 -43.87 64.34 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.747 -1.115 . . . . 1.2 112.262 176.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.685 ' HG3' ' O ' ' A' ' 102' ' ' MET . 38.0 mt-30 -64.3 -40.65 96.37 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.952 0.882 . . . . 2.37 108.966 179.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.696 HG13 ' O ' ' A' ' 103' ' ' THR . 7.8 mt -68.88 -42.22 82.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-N 114.29 -1.323 . . . . 0.15 111.163 -178.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.616 HD12 HD11 ' A' ' 48' ' ' LEU . 7.2 mt -66.91 -37.64 79.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.413 -0.358 . . . . 0.19 111.471 -178.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 46.4 t -59.58 -28.85 67.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.699 0.285 . . . . 1.14 110.587 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 89.8 mtt180 -59.41 -53.6 56.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.281 -0.637 . . . . 1.64 109.281 173.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.558 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 11.5 m-85 -86.99 32.97 0.66 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.2 -0.909 . . . . 0.65 110.265 176.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? -122.19 -44.62 2.27 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 107.384 -1.339 . . . . 0.76 107.384 174.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -70.4 -37.34 74.48 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.743 -1.117 . . . . 2.27 109.392 168.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -106.41 61.01 0.64 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.361 -0.836 . . . . 1.2 109.761 175.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.558 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 35.2 t70 . . . . . 0 C--O 1.249 1.038 0 CA-C-N 115.268 -0.878 . . . . 2.72 110.313 -178.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 N-CA-C 111.685 -0.566 . . . . 19.89 111.685 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . 0.476 ' HB3' ' HB2' ' B' ' 523' ' ' TYR . 49.0 m -131.25 80.73 67.63 Favored Pre-proline 0 C--N 1.321 -0.665 0 CA-C-O 120.721 0.296 . . . . 18.33 110.458 -179.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -73.8 85.14 1.36 Allowed 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.789 2.326 . . . . 17.39 112.704 -178.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 88.75 40.38 6.31 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.774 -0.727 . . . . 16.36 112.653 177.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . 0.476 ' HB2' ' HB3' ' B' ' 520' ' ' SER . 97.4 m-85 -126.67 79.92 70.98 Favored Pre-proline 0 C--N 1.326 -0.423 0 N-CA-C 110.27 -0.271 . . . . 16.0 110.27 178.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -86.86 15.25 2.23 Favored 'Trans proline' 0 N--CA 1.461 -0.41 0 C-N-CA 122.555 2.17 . . . . 13.15 113.032 -178.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . 0.402 HD22 ' HA ' ' B' ' 525' ' ' ASN . 2.2 t-20 53.42 40.67 31.69 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.641 -0.709 . . . . 12.36 110.326 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -87.34 -81.03 1.21 Allowed Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.845 -0.693 . . . . 9.63 112.973 -175.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -139.95 24.6 2.36 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.984 0.421 . . . . 8.34 111.168 -177.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 64.4 mt -73.07 8.74 1.45 Allowed 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 112.993 0.738 . . . . 10.41 112.993 -172.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 6.8 m -143.32 -47.91 0.3 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.033 0.444 . . . . 7.62 111.581 -178.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 113.22 -2.94 25.32 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 110.445 -1.062 . . . . 5.19 110.445 -171.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -142.25 40.39 1.61 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.26 -0.97 . . . . 5.5 108.751 179.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . 0.42 ' HA ' ' HB3' ' B' ' 536' ' ' SER . 22.6 mm-40 -95.9 -2.47 47.2 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.482 -0.781 . . . . 5.68 112.438 -171.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -96.76 -62.63 1.23 Allowed 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.761 -0.654 . . . . 3.22 112.66 -171.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -114.76 -40.57 3.53 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.191 0.52 . . . . 4.27 111.073 -175.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . 0.522 ' HB2' HH22 ' A' ' 61' ' ' ARG . 2.9 p -75.47 -3.11 32.09 Favored 'General case' 0 C--N 1.311 -1.084 0 CA-C-N 115.479 -0.782 . . . . 1.25 110.415 -179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . 0.42 ' HB3' ' HA ' ' B' ' 532' ' ' GLU . 56.1 p -77.44 -56.29 4.67 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.328 -0.851 . . . . 2.08 109.69 172.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 44.9 mm -70.3 -38.71 75.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 115.356 -0.838 . . . . 1.29 110.267 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -76.29 3.03 11.72 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.886 -0.597 . . . . 0.76 111.168 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.493 ' HB2' ' O ' ' B' ' 535' ' ' SER . 27.4 t70 -89.42 -43.51 10.82 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.901 -0.777 . . . . 1.23 108.901 172.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 52.7 mtm -65.38 -30.54 71.37 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.301 -0.863 . . . . 2.29 109.467 172.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -53.51 -40.65 65.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.827 -1.079 . . . . 1.18 110.529 171.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.438 ' HZ ' ' C ' ' A' ' 50' ' ' ALA . 0.2 OUTLIER -82.97 -42.5 17.51 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.747 -1.115 . . . . 0.56 111.272 -173.411 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 14.8 t -56.84 -36.32 69.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.658 -0.701 . . . . 1.58 111.143 -175.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -71.78 -28.21 63.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.316 -0.402 . . . . 0.84 111.502 -179.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 87.0 mt -70.38 -39.89 74.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.246 -0.433 . . . . 1.08 111.924 -176.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . 0.505 HD13 HE21 ' A' ' 49' ' ' GLN . 5.1 mt -84.71 -7.62 59.15 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.33 0.586 . . . . 0.97 109.91 -178.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 29.7 t -110.05 21.94 16.19 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.032 -0.985 . . . . 1.42 110.487 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 76.6 mm-40 -68.17 -54.4 18.18 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.6 0.714 . . . . 2.67 110.689 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 31.6 mt -85.24 74.17 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.148 0 CA-C-N 114.801 -1.091 . . . . 5.23 109.591 177.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 5.7 p -80.95 72.8 7.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.781 -0.645 . . . . 6.4 110.888 -179.461 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 51.0 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.462 -0.78 . . . . 7.59 110.218 178.681 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo . . . . . 0 N--CA 1.479 0.663 0 N-CA-C 110.66 -0.554 . . . . 1.89 110.66 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 10.5 p -65.19 -27.9 69.02 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.034 0.383 . . . . 2.05 112.034 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.561 ' HA ' HD12 ' A' ' 18' ' ' ILE . 74.5 m80 70.11 -9.23 0.75 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.502 0.721 . . . . 0.75 112.015 -178.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.1 p -154.27 163.19 40.52 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 119.817 -0.753 . . . . 1.09 112.293 -176.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.529 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 177.0 -158.0 23.41 Favored Glycine 0 N--CA 1.441 -0.973 0 N-CA-C 110.424 -1.07 . . . . 0.16 110.424 -179.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.422 ' HA ' HD13 ' A' ' 15' ' ' ILE . . . -102.54 135.07 44.83 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 117.386 0.593 . . . . 0.16 110.472 179.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.522 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -147.26 142.74 27.53 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.274 -0.421 . . . . 0.11 111.247 -177.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.782 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 62.3 mt -101.72 126.46 55.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 109.993 -0.373 . . . . 0.33 109.993 175.041 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.442 ' O ' HG13 ' A' ' 12' ' ' VAL . 21.2 t80 -129.51 129.92 45.14 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 108.581 -0.896 . . . . 0.36 108.581 177.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 62.45 29.12 17.1 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 123.386 0.429 . . . . 0.8 110.5 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm 68.52 -0.12 2.38 Favored 'General case' 0 N--CA 1.463 0.208 0 N-CA-C 112.982 0.734 . . . . 2.11 112.982 178.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.442 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.7 OUTLIER -92.86 116.86 34.96 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 108.228 -1.027 . . . . 0.22 108.228 166.915 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.5 p -73.24 142.27 47.28 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.29 -0.414 . . . . 1.07 110.42 -176.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.493 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -158.42 -158.17 8.87 Favored Glycine 0 N--CA 1.438 -1.21 0 C-N-CA 119.835 -1.174 . . . . 0.11 113.732 -176.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.422 HD13 ' HA ' ' A' ' 6' ' ' ALA . 18.8 mm -125.98 132.02 71.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 114.972 -0.614 . . . . 0.13 109.451 -177.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.543 HD11 HD11 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.25 136.38 34.73 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 110.014 -0.365 . . . . 0.13 110.014 -177.181 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.09 129.84 30.37 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.9 0.381 . . . . 0.1 111.318 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.561 HD12 ' HA ' ' A' ' 3' ' ' HIS . 65.4 mt -86.25 132.64 31.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 110.011 -0.366 . . . . 0.27 110.011 177.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -105.29 101.88 11.4 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.128 -0.487 . . . . 1.24 110.608 -175.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -116.5 167.95 10.6 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 109.374 -0.602 . . . . 1.2 109.374 175.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.8 t70 76.8 -2.56 2.66 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 122.165 0.984 . . . . 0.58 109.964 -175.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.614 HG23 ' O ' ' A' ' 23' ' ' SER . 30.4 m -102.64 -174.52 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.022 0 CA-C-N 114.051 -1.431 . . . . 0.25 109.324 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.614 ' O ' HG23 ' A' ' 22' ' ' VAL . 75.6 m -72.4 167.14 35.36 Favored Pre-proline 0 C--N 1.314 -0.942 0 N-CA-C 105.198 -2.149 . . . . 1.13 105.198 175.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.429 ' O ' ' HG2' ' A' ' 26' ' ' GLU . 94.8 Cg_exo -41.9 127.75 3.78 Favored 'Trans proline' 0 C--N 1.354 0.85 0 CA-C-N 121.213 1.469 . . . . 0.16 112.136 -141.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.481 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.07 139.32 23.32 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 113.97 -1.468 . . . . 0.1 112.17 -163.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 24' ' ' PRO . 0.7 OUTLIER -125.48 168.44 13.63 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 114.225 -1.352 . . . . 0.32 111.823 -169.847 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.765 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -116.83 105.42 12.35 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 107.365 -1.346 . . . . 0.09 107.365 174.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.6 m -101.85 107.09 18.17 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 121.061 0.458 . . . . 0.17 111.122 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 81.9 t90 -85.21 132.04 34.34 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 109.044 -0.725 . . . . 0.14 109.044 172.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.723 ' HG2' HG23 ' A' ' 37' ' ' VAL . 66.2 mtp180 -123.06 163.22 20.92 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 109.039 -0.726 . . . . 1.91 109.039 172.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 p -71.26 177.52 3.83 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 108.95 -0.759 . . . . 0.6 108.95 176.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.493 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.0 OUTLIER -58.34 -36.68 73.81 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.316 -0.553 . . . . 0.26 111.017 179.684 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -88.98 -31.23 18.23 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.608 0.718 . . . . 2.12 109.91 171.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.62 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 96.76 16.25 36.96 Favored Glycine 0 N--CA 1.447 -0.613 0 CA-C-N 114.978 -1.01 . . . . 0.23 112.1 178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -62.18 -43.47 98.75 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.084 -0.71 . . . . 1.73 109.084 172.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 49.1 tttt -89.9 141.73 28.37 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.76 -0.83 . . . . 1.3 108.76 174.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.723 HG23 ' HG2' ' A' ' 30' ' ' ARG . 7.9 p -149.4 136.46 13.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-O 120.942 0.401 . . . . 0.17 111.272 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -144.28 127.26 16.44 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.634 -0.506 . . . . 0.41 109.634 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 36.7 m -117.11 132.83 56.58 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.812 0.671 . . . . 0.15 112.812 -173.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.765 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -99.27 130.05 48.81 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.611 0 N-CA-C 108.017 -1.105 . . . . 0.12 108.017 168.693 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.421 ' O ' HG12 ' A' ' 45' ' ' ILE . 57.8 t -93.16 122.31 44.55 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 O-C-N 121.071 -1.018 . . . . 0.11 109.099 173.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.603 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.38 -19.38 63.83 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.736 0.643 . . . . 0.08 112.736 -170.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.422 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 13.7 p -69.8 -12.29 61.51 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.366 0.603 . . . . 0.87 109.635 174.812 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.4 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 4.7 p -112.62 13.8 20.02 Favored 'General case' 0 N--CA 1.444 -0.756 0 CA-C-N 115.328 -0.851 . . . . 0.15 109.879 179.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.554 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.5 mm -114.97 144.77 21.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 109.303 -0.629 . . . . 0.12 109.303 177.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -114.85 -37.39 4.2 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.691 0.281 . . . . 0.52 111.168 -177.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.45 ' O ' ' HG ' ' A' ' 48' ' ' LEU . 9.8 mtmm -139.26 168.8 19.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.732 0.301 . . . . 1.41 111.43 -179.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.815 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -152.04 137.97 18.1 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 109.408 -0.59 . . . . 0.73 109.408 -179.521 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.421 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 8.4 mm100 -134.53 115.21 13.64 Favored 'General case' 0 N--CA 1.473 0.707 0 O-C-N 122.175 -0.328 . . . . 1.94 111.505 -171.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.567 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -114.44 144.41 43.35 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 121.765 -0.584 . . . . 0.22 112.195 -177.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.449 ' N ' ' HZ ' ' B' ' 542' ' ' PHE . 69.0 p -68.55 119.66 70.05 Favored Pre-proline 0 C--O 1.233 0.237 0 CA-C-N 115.418 -0.81 . . . . 0.26 110.784 -176.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_exo -53.84 155.16 14.96 Favored 'Trans proline' 0 N--CA 1.463 -0.266 0 C-N-CA 122.798 2.332 . . . . 0.38 111.723 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.6 -17.09 62.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.782 -0.645 . . . . 0.66 112.402 -174.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.5 t -99.81 -7.79 24.99 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.806 0.336 . . . . 1.5 110.766 178.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 39.2 m -71.87 138.5 48.27 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.218 0.532 . . . . 0.85 111.482 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -55.78 -23.66 31.16 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.038 -0.983 . . . . 1.77 111.084 177.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 40.5 mmtm -88.67 148.55 23.96 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.874 -1.057 . . . . 1.63 111.875 -174.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.619 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -118.87 95.46 4.84 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.12 -1.067 . . . . 1.11 108.12 166.609 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.619 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.2 OUTLIER -157.5 158.56 35.95 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.524 0.678 . . . . 0.22 112.505 -173.793 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -140.67 119.89 12.94 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.651 -1.158 . . . . 0.1 108.318 178.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.706 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.2 mtp180 -102.53 147.53 26.65 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.426 0.631 . . . . 2.99 112.014 -178.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.922 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -125.32 105.3 9.0 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 114.431 -1.259 . . . . 0.13 108.987 178.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.528 HD12 ' N ' ' A' ' 63' ' ' ILE . 3.1 mp -88.91 106.15 16.54 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 N-CA-C 110.137 -0.32 . . . . 0.29 110.137 -174.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.76 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -66.52 166.2 39.05 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.936 -0.575 . . . . 0.54 112.925 -178.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.528 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 83.0 mttt -84.33 124.34 31.16 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 120.861 0.363 . . . . 0.55 111.362 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.651 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 2.2 t -121.44 138.84 50.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 115.905 -0.589 . . . . 1.73 110.39 172.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.562 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 14.0 m-20 -83.21 80.42 9.07 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.433 -0.803 . . . . 3.23 108.995 177.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -69.25 -2.6 11.01 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.957 0.408 . . . . 2.39 111.42 -174.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.9 p -65.12 -17.33 64.38 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.524 -0.547 . . . . 2.96 109.524 169.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.562 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -79.42 132.53 36.41 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.187 0.994 . . . . 2.49 110.528 176.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 30.4 mmtm -101.4 116.85 33.73 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 114.646 -1.161 . . . . 3.4 109.246 167.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 41.0 ttm180 -99.33 157.57 16.31 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.463 -0.94 . . . . 3.8 108.463 176.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 50.9 mttp -128.25 147.19 50.58 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.811 -0.441 . . . . 4.29 109.811 174.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.436 ' HB2' ' HG3' ' B' ' 524' ' ' PRO . 0.6 OUTLIER -90.29 -172.86 3.61 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.554 -0.748 . . . . 4.41 110.483 -175.868 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -58.55 -31.42 67.95 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 112.093 0.405 . . . . 5.34 112.093 -178.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.591 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 30.8 mt-10 -85.49 -22.69 28.1 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.907 -0.317 . . . . 5.38 110.96 -178.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 105.7 19.11 10.65 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.624 -0.798 . . . . 4.37 112.38 -179.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.591 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 37.9 m-80 -77.88 140.61 39.34 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 109.383 -0.599 . . . . 4.51 109.383 177.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -74.23 95.67 2.66 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.469 -0.567 . . . . 4.28 109.469 178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.3 m -107.88 98.79 7.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 109.003 -0.739 . . . . 3.1 109.003 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.426 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -89.0 114.55 60.62 Favored Pre-proline 0 C--N 1.316 -0.866 0 CA-C-N 115.892 -0.595 . . . . 2.5 110.375 -175.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 25.5 Cg_exo -67.0 135.97 39.5 Favored 'Trans proline' 0 CA--C 1.51 -0.721 0 C-N-CA 123.036 2.491 . . . . 1.87 113.716 -174.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.522 ' HG3' ' OH ' ' B' ' 523' ' ' TYR . 37.1 mtmm -95.43 162.46 24.47 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 114.18 -1.373 . . . . 2.74 109.309 172.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.76 ' HB3' ' O ' ' A' ' 64' ' ' GLY . 50.3 Cg_exo -50.54 152.47 8.95 Favored 'Trans proline' 0 C--O 1.233 0.234 0 C-N-CA 122.949 2.433 . . . . 0.84 113.617 179.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -91.58 124.44 35.74 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.181 -0.918 . . . . 1.57 109.615 -178.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.495 ' HG2' HG13 ' A' ' 63' ' ' ILE . 78.8 mtt180 -104.54 126.39 51.58 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 121.727 0.775 . . . . 2.52 111.079 -172.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 79.5 m-70 -95.25 146.3 24.44 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.505 -1.295 . . . . 0.72 107.505 177.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.706 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 19.5 ttm -140.74 130.55 24.39 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 118.914 0.779 . . . . 0.27 111.309 175.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.551 ' O ' ' HA ' ' A' ' 59' ' ' MET . 11.6 m-85 -116.61 138.05 51.72 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.371 -0.831 . . . . 0.27 109.614 178.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.782 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -81.06 159.04 24.87 Favored 'General case' 0 C--N 1.313 -1.019 0 N-CA-C 109.078 -0.712 . . . . 1.26 109.078 174.381 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.419 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 18.1 m-85 -138.34 175.47 9.55 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.91 0.386 . . . . 0.32 111.478 -179.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -130.63 -0.75 4.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.828 -0.624 . . . . 2.38 110.115 175.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.505 ' HB2' HG23 ' A' ' 96' ' ' VAL . 62.2 m-80 -147.1 133.55 19.69 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 116.176 -0.465 . . . . 1.1 110.223 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.429 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 36.0 mmt180 -72.01 -39.2 69.36 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.632 -0.713 . . . . 3.09 111.208 -178.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.4 m -60.84 -33.44 73.05 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.994 -0.548 . . . . 0.35 110.696 -177.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.638 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.3 t -67.25 -61.44 1.69 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.377 0 CA-C-N 116.052 -0.522 . . . . 0.23 110.247 176.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.581 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.3 ptp -54.69 -38.58 67.18 Favored 'General case' 0 CA--C 1.52 -0.202 0 CA-C-N 116.25 -0.432 . . . . 0.17 111.234 -175.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.435 ' O ' ' HB2' ' A' ' 102' ' ' MET . 29.9 t70 -62.98 -47.72 81.93 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.333 -0.394 . . . . 0.34 110.511 177.369 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -68.95 -39.01 79.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.992 -0.549 . . . . 1.36 111.619 -179.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.668 HG22 HD11 ' A' ' 104' ' ' LEU . 35.7 mm -63.36 -58.92 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.372 0 N-CA-C 109.039 -0.726 . . . . 0.12 109.039 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.811 ' HA ' HD12 ' A' ' 104' ' ' LEU . 14.6 ttpp -51.25 -47.76 62.34 Favored 'General case' 0 CA--C 1.508 -0.64 0 O-C-N 123.795 0.684 . . . . 0.79 109.818 177.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.69 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 37.8 ttp -51.19 -55.28 18.77 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.065 -0.971 . . . . 0.28 110.943 179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.735 ' O ' HG13 ' A' ' 107' ' ' ILE . 31.9 m -60.41 -51.74 68.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.284 -0.416 . . . . 0.18 110.455 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.922 HD13 HD21 ' A' ' 62' ' ' LEU . 31.7 mt -47.38 -54.96 9.85 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.409 0.684 . . . . 0.09 110.312 175.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.666 ' CG ' HD13 ' A' ' 48' ' ' LEU . 23.5 mt-30 -53.7 -39.1 64.9 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 114.502 -1.226 . . . . 1.2 112.565 178.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.69 ' HG3' ' O ' ' A' ' 102' ' ' MET . 64.5 mt-30 -67.2 -42.46 84.09 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-O 121.863 0.839 . . . . 2.37 109.04 177.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.735 HG13 ' O ' ' A' ' 103' ' ' THR . 14.1 mt -64.8 -46.79 90.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-N 114.298 -1.319 . . . . 0.15 110.997 -179.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.815 HD12 HD11 ' A' ' 48' ' ' LEU . 7.6 mt -61.95 -32.22 53.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.841 -0.618 . . . . 0.19 111.222 -178.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.408 ' HA ' ' HB2' ' A' ' 112' ' ' LYS . 38.5 t -61.44 -31.51 71.45 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.488 -0.324 . . . . 1.14 110.399 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 72.2 mtt180 -63.57 -40.19 96.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.375 0.607 . . . . 1.64 109.387 175.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.422 ' CG ' ' HA ' ' A' ' 43' ' ' SER . 35.0 m-85 -97.7 18.28 15.98 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.445 -0.798 . . . . 0.65 110.103 179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.408 ' HB2' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER -103.09 -41.22 6.16 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 107.717 -1.216 . . . . 0.76 107.717 175.655 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -70.39 -36.53 74.14 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 114.773 -1.103 . . . . 2.27 109.457 169.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -105.89 54.73 0.69 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.315 -0.857 . . . . 1.2 109.894 174.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.512 ' OD2' ' HE2' ' A' ' 65' ' ' LYS . 11.1 t70 . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.662 -0.685 . . . . 2.72 110.028 -178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.671 0 N-CA-C 111.833 -0.507 . . . . 19.89 111.833 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 5.4 p -90.46 144.79 31.29 Favored Pre-proline 0 C--N 1.321 -0.655 0 N-CA-C 110.487 -0.19 . . . . 18.33 110.487 -179.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 98.1 Cg_endo -76.27 41.71 0.9 Allowed 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.02 2.48 . . . . 17.39 112.233 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 84.61 5.31 86.84 Favored Glycine 0 N--CA 1.446 -0.685 0 CA-C-N 115.782 -0.644 . . . . 16.36 112.491 -179.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . 0.522 ' OH ' ' HG3' ' A' ' 83' ' ' LYS . 76.8 m-85 -140.96 134.78 14.92 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 120.822 0.344 . . . . 16.0 111.203 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . 0.436 ' HG3' ' HB2' ' A' ' 74' ' ' ASP . 92.8 Cg_endo -78.14 170.0 19.41 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.061 2.508 . . . . 13.15 111.992 176.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 58.9 t30 63.8 79.56 0.25 Allowed 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.447 0.641 . . . . 12.36 110.18 -177.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -63.07 -33.96 88.67 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.455 -0.793 . . . . 9.63 113.562 -173.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.838 HD13 ' H ' ' B' ' 527' ' ' LEU . 0.0 OUTLIER -79.49 8.95 5.41 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 117.274 0.537 . . . . 8.34 112.423 -176.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 40.8 tp -75.71 -5.52 46.06 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 107.777 -1.194 . . . . 10.41 107.777 168.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 65.0 m -161.02 60.33 0.3 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 113.766 -1.561 . . . . 7.62 107.727 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -48.21 -40.03 21.22 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 114.935 -1.03 . . . . 5.19 114.511 -169.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 13.4 m-20 -123.33 11.62 9.37 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.067 0.461 . . . . 5.5 110.096 178.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -110.19 -2.2 16.99 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 115.738 -0.665 . . . . 5.68 111.882 -176.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -81.7 -33.64 31.07 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.005 -0.543 . . . . 3.22 109.983 178.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -65.86 -39.74 91.02 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.633 0.73 . . . . 4.27 110.131 176.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 3.7 p -73.17 -20.36 60.91 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 115.004 -0.998 . . . . 1.25 110.513 178.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . 0.409 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 71.2 m -74.17 -35.23 63.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.345 -0.388 . . . . 2.08 110.328 174.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . 0.477 HD13 ' HA ' ' B' ' 537' ' ' ILE . 9.8 mm -76.77 -31.42 19.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 121.015 0.436 . . . . 1.29 110.381 174.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -75.98 3.28 10.59 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.389 0.614 . . . . 0.76 110.427 175.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.568 ' HB2' ' NH1' ' A' ' 61' ' ' ARG . 26.3 t70 -84.16 -31.88 24.92 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.295 -0.866 . . . . 1.23 109.461 174.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -60.92 -26.91 67.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.334 -0.848 . . . . 2.29 110.431 176.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -61.81 -37.68 85.32 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.955 -0.566 . . . . 1.18 110.005 176.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.449 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -69.5 -35.04 75.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.46 -0.791 . . . . 0.56 111.583 -175.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 23.0 t -58.16 -33.25 69.01 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.971 -0.559 . . . . 1.58 110.556 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -78.36 -32.76 49.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.108 -0.496 . . . . 0.84 110.857 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.56 ' O ' ' HG3' ' B' ' 548' ' ' GLN . 88.2 mt -76.39 -37.98 56.35 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.599 0.592 . . . . 1.08 112.599 -175.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . 0.401 HD11 ' HB3' ' A' ' 49' ' ' GLN . 20.3 mt -81.52 -11.2 59.27 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.53 0.681 . . . . 0.97 109.978 -177.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 43.3 m -92.6 -56.12 3.13 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 114.955 -1.021 . . . . 1.42 110.238 173.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . 0.56 ' HG3' ' O ' ' B' ' 545' ' ' LEU . 86.2 mt-30 51.89 54.33 11.08 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.227 0.537 . . . . 2.67 110.992 -179.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 49.5 mm -115.5 -44.47 3.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.394 -0.821 . . . . 5.23 109.773 178.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 32.5 t -113.69 24.11 12.45 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.634 -0.712 . . . . 6.4 109.921 179.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 50.5 m . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.369 -0.824 . . . . 7.59 109.784 178.866 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo . . . . . 0 N--CA 1.477 0.517 0 N-CA-C 110.567 -0.59 . . . . 1.89 110.567 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.4 m -47.65 -60.17 2.75 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.914 1.079 . . . . 2.05 113.914 -171.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 73.1 m80 65.53 -11.29 0.18 Allowed 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.159 0.583 . . . . 0.75 112.365 -173.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.2 p -156.91 166.2 34.02 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.519 0.563 . . . . 1.09 112.519 -171.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.482 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 174.45 -166.67 38.68 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 110.595 -1.002 . . . . 0.16 110.595 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.3 134.33 36.9 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 117.798 0.799 . . . . 0.16 110.301 178.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.424 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -147.36 144.74 28.95 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.171 0.51 . . . . 0.11 111.628 -178.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.498 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 98.2 mt -102.79 119.42 51.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.848 -0.615 . . . . 0.33 110.166 176.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.428 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.8 t80 -126.1 137.2 53.59 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 109.142 -0.688 . . . . 0.36 109.142 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 62.07 22.95 13.48 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.522 0.514 . . . . 0.8 109.761 -175.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt 67.92 5.22 4.4 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 115.279 -0.873 . . . . 2.11 112.764 -179.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.428 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.5 OUTLIER -95.48 126.88 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 108.671 -0.863 . . . . 0.22 108.671 166.447 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.456 ' HA ' HG12 ' A' ' 8' ' ' ILE . 27.3 p -77.35 142.8 39.16 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.226 0.536 . . . . 1.07 111.049 -175.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.92 -158.59 9.8 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 120.26 -0.971 . . . . 0.11 113.228 -177.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 35.1 mm -125.29 131.41 72.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 109.351 -0.611 . . . . 0.13 109.351 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.57 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -101.99 135.07 40.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 120.788 0.327 . . . . 0.13 110.144 -176.726 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.65 130.95 32.98 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.22 -0.446 . . . . 0.1 111.024 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.439 HD13 ' CG2' ' A' ' 103' ' ' THR . 34.3 mt -85.03 137.44 20.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.271 0.557 . . . . 0.27 110.171 177.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -109.31 105.05 14.3 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.144 -0.935 . . . . 1.24 111.232 -173.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.49 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 0.0 OUTLIER -124.05 169.96 11.14 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.168 -0.469 . . . . 1.2 109.744 176.04 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.49 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.6 t70 80.96 -6.12 1.64 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-O 122.452 1.12 . . . . 0.58 109.293 -173.077 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 23' ' ' SER . 32.4 m -102.33 -172.48 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.085 0 CA-C-N 113.699 -1.591 . . . . 0.25 109.128 179.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.602 ' O ' HG23 ' A' ' 22' ' ' VAL . 19.9 m -72.07 167.48 31.42 Favored Pre-proline 0 C--N 1.316 -0.878 0 N-CA-C 105.687 -1.968 . . . . 1.13 105.687 175.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 23' ' ' SER . 63.9 Cg_exo -41.7 127.39 3.47 Favored 'Trans proline' 0 C--N 1.352 0.719 0 CA-C-N 120.81 1.325 . . . . 0.16 112.728 -143.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.461 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -45.22 138.15 4.13 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 113.61 -1.632 . . . . 0.1 112.739 -166.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -124.55 169.34 12.0 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 113.908 -1.496 . . . . 0.32 111.615 -169.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.709 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.81 108.92 15.94 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 107.761 -1.2 . . . . 0.09 107.761 173.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 10.3 m -104.26 108.26 19.57 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-O 121.015 0.436 . . . . 0.17 111.176 -176.133 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.42 ' CD2' ' HB3' ' A' ' 9' ' ' PHE . 84.2 t90 -86.43 130.45 34.5 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 109.211 -0.662 . . . . 0.14 109.211 172.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.52 ' HG2' HG23 ' A' ' 37' ' ' VAL . 78.1 mtt180 -123.36 157.3 33.62 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 109.027 -0.731 . . . . 1.91 109.027 172.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.2 p -70.38 177.95 3.14 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.486 -0.561 . . . . 0.6 109.486 178.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.2 p -62.45 -38.29 89.21 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 119.905 -0.718 . . . . 0.26 110.405 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -78.8 -33.01 46.56 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.811 0.815 . . . . 2.12 108.969 171.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.457 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 91.89 10.53 61.3 Favored Glycine 0 N--CA 1.446 -0.689 0 CA-C-N 114.459 -1.246 . . . . 0.23 112.637 177.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -65.44 -48.79 71.52 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.586 -0.524 . . . . 1.73 109.586 175.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.4 tttm -77.25 134.31 38.61 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.821 -0.807 . . . . 1.3 108.821 172.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.52 HG23 ' HG2' ' A' ' 30' ' ' ARG . 13.6 p -149.39 136.49 13.25 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 120.672 0.273 . . . . 0.17 110.701 -177.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.0 t60 -144.49 132.85 21.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.667 0.27 . . . . 0.41 110.316 178.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.434 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 37.0 m -116.52 133.43 56.02 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.501 0.556 . . . . 0.15 112.501 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.709 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.44 129.8 53.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.599 0 N-CA-C 108.383 -0.969 . . . . 0.12 108.383 169.247 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 96.6 t -92.53 119.63 40.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 O-C-N 121.207 -0.933 . . . . 0.11 108.805 173.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.53 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -66.94 -18.18 65.26 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.984 0.735 . . . . 0.08 112.984 -170.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.425 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 44.3 t -70.81 -14.94 62.6 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 120.204 -0.598 . . . . 0.87 109.624 175.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.447 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 3.5 p -109.34 9.97 25.61 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 115.517 -0.765 . . . . 0.15 110.002 -178.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.56 HG21 HD13 ' A' ' 62' ' ' LEU . 31.0 mm -110.36 137.91 40.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.831 -0.622 . . . . 0.12 109.327 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -103.29 -40.22 6.49 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.319 -0.4 . . . . 0.52 110.591 -175.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.591 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 25.2 mtpp -139.79 174.51 10.44 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-O 121.406 0.622 . . . . 1.41 111.962 -178.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.637 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -152.92 137.57 16.9 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.785 -1.098 . . . . 0.73 108.754 176.898 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -134.02 118.41 17.78 Favored 'General case' 0 C--O 1.221 -0.395 0 O-C-N 122.436 -0.165 . . . . 1.94 111.416 -173.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.454 ' HB2' ' HG ' ' A' ' 60' ' ' LEU . . . -117.42 144.09 45.34 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 122.062 -0.399 . . . . 0.22 111.693 -177.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.514 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 74.2 p -70.67 121.28 83.25 Favored Pre-proline 0 N--CA 1.463 0.202 0 CA-C-N 115.884 -0.598 . . . . 0.26 111.162 -175.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.56 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 22.6 Cg_exo -58.41 160.55 16.45 Favored 'Trans proline' 0 CA--C 1.528 0.204 0 C-N-CA 122.866 2.378 . . . . 0.38 111.939 175.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.16 -13.92 62.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.112 -0.494 . . . . 0.66 111.364 -177.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.3 p -91.87 -15.49 28.07 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.263 0.554 . . . . 1.5 110.547 176.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.56 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 20.9 m -71.85 143.26 49.49 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.618 -0.719 . . . . 0.85 111.608 -179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -69.16 -8.32 44.44 Favored 'General case' 0 CA--C 1.517 -0.312 0 CA-C-N 114.951 -1.022 . . . . 1.77 110.653 176.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.473 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 30.5 mmtm -105.39 155.74 18.84 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-N 114.79 -1.095 . . . . 1.63 111.121 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.514 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 72.5 mmm -133.0 98.27 4.24 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.174 -0.676 . . . . 1.11 109.174 169.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.568 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.2 OUTLIER -157.88 160.59 37.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.01 -0.541 . . . . 0.22 111.562 -171.037 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -136.99 118.77 15.09 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.387 -0.968 . . . . 0.1 108.387 176.748 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.482 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 2.2 mtp180 -103.64 136.87 42.55 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-O 121.211 0.529 . . . . 2.99 111.439 -178.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.923 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -109.03 107.6 18.0 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.055 -0.975 . . . . 0.13 109.243 174.039 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.591 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.3 mp -85.56 101.7 10.31 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 N-CA-C 110.137 -0.32 . . . . 0.29 110.137 -174.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.479 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -65.25 153.62 50.64 Favored Glycine 0 N--CA 1.449 -0.475 0 CA-C-N 116.111 -0.495 . . . . 0.54 112.273 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.447 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 86.8 mttt -70.4 150.28 46.42 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.129 0.49 . . . . 0.55 111.758 -176.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.452 ' CG2' ' HG3' ' A' ' 84' ' ' PRO . 0.8 OUTLIER -107.27 110.75 32.93 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.747 0 CA-C-N 115.677 -0.692 . . . . 1.73 111.67 -173.369 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.832 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 15.2 t70 -88.0 86.37 7.11 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 107.965 -1.124 . . . . 3.23 107.965 168.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -75.76 -9.09 58.3 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.773 0.321 . . . . 2.39 110.963 -174.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.1 p -66.87 -9.52 38.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.061 0.458 . . . . 2.96 110.618 174.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.832 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 4.9 ptpp? -86.43 33.3 0.63 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.011 -0.541 . . . . 2.49 110.386 173.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 1.5 mtpt -43.72 113.33 0.5 Allowed 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.474 0.654 . . . . 3.4 109.746 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.506 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 73.5 ttt180 -102.07 165.67 11.03 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 114.872 -1.058 . . . . 3.8 109.064 -167.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 85.8 mttt -134.67 150.43 50.63 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.607 -0.516 . . . . 4.29 109.607 171.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.495 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.8 OUTLIER -84.69 -170.85 3.32 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.606 -0.725 . . . . 4.41 110.416 -177.619 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -59.15 -32.13 69.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.772 0.32 . . . . 5.34 111.619 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.495 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 19.4 mt-10 -80.68 -45.13 17.67 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.931 0.396 . . . . 5.38 110.528 -179.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 130.77 17.08 1.55 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.69 -0.767 . . . . 4.37 112.466 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.561 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 36.6 m-80 -76.03 133.7 40.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 109.703 -0.48 . . . . 4.51 109.703 178.336 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.444 ' HA ' ' HG2' ' A' ' 73' ' ' LYS . 43.7 tt0 -71.16 93.76 1.09 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.255 0.55 . . . . 4.28 110.499 -179.505 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.506 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 28.3 m -98.75 100.17 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-O 121.727 0.775 . . . . 3.1 109.455 177.024 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -86.88 107.48 14.37 Favored Pre-proline 0 C--N 1.316 -0.873 0 N-CA-C 108.715 -0.846 . . . . 2.5 108.715 176.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_exo -58.1 139.05 89.04 Favored 'Trans proline' 0 C--O 1.235 0.35 0 C-N-CA 123.535 2.824 . . . . 1.87 113.579 -170.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.554 ' HB2' ' HD2' ' A' ' 84' ' ' PRO . 17.9 ptpt -80.46 168.91 22.1 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 114.73 -1.123 . . . . 2.74 109.688 176.601 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.554 ' HD2' ' HB2' ' A' ' 83' ' ' LYS . 21.0 Cg_exo -57.05 150.29 57.27 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.006 1.804 . . . . 0.84 112.251 -178.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 30.7 mt-30 -88.4 111.87 22.26 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 108.351 -0.981 . . . . 1.57 108.351 177.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.427 ' HG2' HG13 ' A' ' 63' ' ' ILE . 95.8 mtt180 -104.47 115.24 30.02 Favored 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.887 -0.597 . . . . 2.52 110.196 -173.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.601 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 57.8 m-70 -93.9 110.24 21.92 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.774 -0.824 . . . . 0.72 108.774 -174.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.568 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 23.5 ttm -102.71 125.03 49.3 Favored 'General case' 0 CA--C 1.502 -0.87 0 C-N-CA 120.05 -0.66 . . . . 0.27 111.012 -175.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.424 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.0 m-85 -112.83 125.33 54.23 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.271 -0.877 . . . . 0.27 109.199 174.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.498 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -81.07 148.41 29.67 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 109.828 -0.434 . . . . 1.26 109.828 178.063 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.436 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 19.8 m-85 -130.01 168.57 16.5 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.283 0.563 . . . . 0.32 111.783 -172.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -120.51 -11.11 9.15 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.143 -0.935 . . . . 2.38 109.833 175.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.482 ' HB2' HG23 ' A' ' 96' ' ' VAL . 53.6 m-80 -136.85 128.67 29.06 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.373 0.606 . . . . 1.1 110.814 -178.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.488 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.2 mmm180 -68.03 -35.91 79.06 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.117 -0.947 . . . . 3.09 111.881 178.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 18.0 m -61.63 -37.97 85.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.783 0.325 . . . . 0.35 110.747 -178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.596 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.5 t -66.17 -58.41 6.78 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 CA-C-N 116.221 -0.445 . . . . 0.23 110.468 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.512 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.0 ptp -55.8 -39.49 71.37 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.333 -0.394 . . . . 0.17 111.286 -176.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.462 ' N ' ' HG3' ' A' ' 97' ' ' MET . 28.7 t70 -65.65 -39.25 91.19 Favored 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.87 -0.332 . . . . 0.34 110.332 179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -74.44 -40.13 62.13 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.175 -0.466 . . . . 1.36 111.433 179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.643 HG22 HD11 ' A' ' 104' ' ' LEU . 30.6 mm -61.72 -57.23 13.06 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 108.692 -0.855 . . . . 0.12 108.692 176.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.769 ' HA ' HD12 ' A' ' 104' ' ' LEU . 30.0 ttpt -50.66 -49.69 56.43 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 124.09 0.868 . . . . 0.79 109.848 176.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.476 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.0 ttp -49.98 -52.65 32.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.562 -0.745 . . . . 0.28 111.26 178.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.678 ' O ' HG13 ' A' ' 107' ' ' ILE . 23.3 m -59.68 -56.82 17.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.992 -0.549 . . . . 0.18 110.169 178.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.923 HD13 HD21 ' A' ' 62' ' ' LEU . 26.4 mt -45.6 -54.79 7.13 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.207 -0.906 . . . . 0.09 110.663 176.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.619 ' CG ' HD13 ' A' ' 48' ' ' LEU . 92.9 mt-30 -51.56 -46.33 63.36 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.704 -1.135 . . . . 1.2 112.488 177.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 102' ' ' MET . 17.5 mm100 -67.14 -34.77 78.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.46 0.648 . . . . 2.37 109.968 -179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.678 HG13 ' O ' ' A' ' 103' ' ' THR . 7.3 mt -71.35 -46.25 65.61 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 114.669 -1.15 . . . . 0.15 110.924 179.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.637 HD12 HD11 ' A' ' 48' ' ' LEU . 6.3 mt -59.24 -42.13 86.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.255 -0.43 . . . . 0.19 111.287 179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.417 ' HA ' ' HB3' ' A' ' 112' ' ' LYS . 26.0 t -57.09 -28.33 62.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.5 -0.318 . . . . 1.14 111.12 -177.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 98.5 mtt180 -60.95 -39.0 87.85 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.408 0.623 . . . . 1.64 109.938 176.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.425 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 21.0 m-85 -94.47 -16.23 23.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.265 -0.88 . . . . 0.65 110.205 -178.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.452 ' HA ' ' OD2' ' A' ' 115' ' ' ASP . 0.0 OUTLIER -71.5 -28.51 63.96 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.527 -0.761 . . . . 0.76 109.039 176.841 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.43 -2.28 45.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.259 -0.882 . . . . 2.27 110.23 172.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -109.48 9.65 25.37 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.329 -0.85 . . . . 1.2 110.248 175.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.452 ' OD2' ' HA ' ' A' ' 112' ' ' LYS . 39.9 m-20 . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.621 -0.704 . . . . 2.72 110.184 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 111.77 -0.532 . . . . 19.89 111.77 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . 0.432 ' HA ' ' HD3' ' B' ' 521' ' ' PRO . 35.3 t -160.56 131.43 3.75 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 110.179 -0.304 . . . . 18.33 110.179 -179.025 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' B' ' 520' ' ' SER . 36.7 Cg_exo -64.63 -7.52 14.81 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 123.107 2.538 . . . . 17.39 112.307 176.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 94.38 -121.24 6.65 Favored Glycine 0 N--CA 1.443 -0.87 0 C-N-CA 121.008 -0.615 . . . . 16.36 111.831 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 8.5 p90 -138.34 139.17 24.33 Favored Pre-proline 0 C--N 1.32 -0.687 0 N-CA-C 110.358 -0.238 . . . . 16.0 110.358 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -54.55 119.34 6.26 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.09 2.527 . . . . 13.15 112.335 179.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -87.75 -24.63 23.75 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.097 -0.501 . . . . 12.36 110.596 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -99.95 29.8 11.39 Favored Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.621 -0.799 . . . . 9.63 112.731 -175.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 1.3 pp -80.95 6.37 13.54 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.36 0.6 . . . . 8.34 111.57 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 30.4 tp -81.14 5.65 16.16 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.346 -0.983 . . . . 10.41 108.346 172.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 30.4 t -151.62 -47.62 0.11 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.304 -1.316 . . . . 7.62 109.248 -177.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 95.41 -41.43 2.48 Favored Glycine 0 N--CA 1.446 -0.668 0 C-N-CA 120.865 -0.683 . . . . 5.19 112.616 176.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -91.64 -14.99 29.2 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-O 122.306 1.05 . . . . 5.5 108.99 -174.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -101.9 2.49 38.1 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 113.962 -1.472 . . . . 5.68 110.95 -175.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -85.72 -32.32 21.97 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 114.725 -1.125 . . . . 3.22 109.996 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 99.6 m-85 -70.21 -34.03 72.41 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.647 -0.706 . . . . 4.27 110.526 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 1.4 p -77.42 -17.03 58.49 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.56 -0.746 . . . . 1.25 110.861 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . 0.49 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 64.5 m -78.14 -34.02 50.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.149 0.499 . . . . 2.08 110.115 175.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 28.5 mm -82.75 -32.28 9.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.095 -0.502 . . . . 1.29 110.024 174.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . 0.423 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -75.88 1.08 16.05 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.796 0.808 . . . . 0.76 110.318 174.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.49 ' HB3' ' O ' ' B' ' 536' ' ' SER . 25.2 t70 -81.33 -40.85 22.95 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.848 -1.069 . . . . 1.23 108.548 171.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 91.5 mtp -64.08 -31.62 72.88 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 114.678 -1.146 . . . . 2.29 109.798 174.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . 0.423 ' HB2' ' HA ' ' B' ' 538' ' ' ALA . 4.7 t70 -55.14 -43.71 74.42 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.146 -0.934 . . . . 1.18 110.198 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.42 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -66.8 -36.72 83.03 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.594 -0.73 . . . . 0.56 111.251 -177.054 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 32.9 t -59.92 -34.57 73.39 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.918 -0.583 . . . . 1.58 110.369 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . 0.467 ' O ' ' HG2' ' B' ' 548' ' ' GLN . . . -80.56 -17.95 49.89 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.94 -0.573 . . . . 0.84 111.472 -179.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 72.6 mt -88.14 -45.93 9.72 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.989 0.423 . . . . 1.08 112.096 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 17.5 mt -74.51 -14.72 60.85 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.32 0.581 . . . . 0.97 110.702 -175.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 25.3 p -79.6 -19.66 48.78 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.584 -0.735 . . . . 1.42 110.419 174.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' B' ' 544' ' ' ALA . 14.8 mm100 -69.6 -40.22 76.78 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.545 0.688 . . . . 2.67 110.732 -179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . 0.476 HD13 ' HG3' ' A' ' 52' ' ' PRO . 32.1 pt -94.21 28.8 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.984 0 CA-C-N 114.678 -1.146 . . . . 5.23 111.368 -177.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 35.0 t -92.47 -1.01 57.28 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.889 0.376 . . . . 6.4 110.218 178.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 32.5 t . . . . . 0 C--O 1.246 0.917 0 CA-C-O 118.462 -0.78 . . . . 7.59 109.341 177.364 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.404 ' HA ' ' OD1' ' A' ' 99' ' ' ASN . 5.3 Cg_endo . . . . . 0 N--CA 1.48 0.735 0 N-CA-C 110.569 -0.589 . . . . 1.89 110.569 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.0 p -76.13 -21.46 56.59 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.753 0.311 . . . . 2.05 111.244 -177.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.58 ' HA ' HD12 ' A' ' 18' ' ' ILE . 77.2 m80 64.65 -0.32 0.98 Allowed 'General case' 0 C--O 1.22 -0.473 0 CA-C-N 115.807 -0.633 . . . . 0.75 112.304 178.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.8 p -157.78 161.77 38.45 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 119.72 -0.792 . . . . 1.09 112.376 -175.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.491 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.02 -165.72 34.84 Favored Glycine 0 N--CA 1.441 -0.974 0 CA-C-N 115.009 -0.996 . . . . 0.16 110.749 -179.226 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.19 130.55 45.51 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.23 0.515 . . . . 0.16 110.44 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.4 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -144.63 143.58 30.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.043 0.449 . . . . 0.11 111.351 -177.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.434 HG12 ' HA ' ' A' ' 13' ' ' SER . 74.2 mt -99.23 128.27 51.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 109.647 -0.501 . . . . 0.33 109.647 174.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.491 ' O ' HG13 ' A' ' 12' ' ' VAL . 15.0 t80 -139.31 138.55 36.79 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.992 -0.744 . . . . 0.36 108.992 178.022 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 64.35 24.88 13.34 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.65 0.594 . . . . 0.8 109.494 -176.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp 65.72 1.02 1.64 Allowed 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 114.992 -1.004 . . . . 2.11 113.027 -178.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -94.53 130.06 43.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 108.863 -0.791 . . . . 0.22 108.863 168.688 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.434 ' HA ' HG12 ' A' ' 8' ' ' ILE . 20.4 m -78.68 144.08 35.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.824 0.345 . . . . 1.07 110.609 -175.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.401 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -162.34 -158.97 9.92 Favored Glycine 0 N--CA 1.439 -1.148 0 C-N-CA 119.92 -1.133 . . . . 0.11 113.743 -176.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.4 mm -127.59 134.53 65.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.862 -0.792 . . . . 0.13 108.862 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.556 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.97 136.91 36.67 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.603 -0.271 . . . . 0.13 110.337 -176.034 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.68 130.03 31.52 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.911 0.386 . . . . 0.1 111.436 -179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.58 HD12 ' HA ' ' A' ' 3' ' ' HIS . 64.3 mt -86.2 135.45 25.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 116.308 -0.405 . . . . 0.27 110.022 177.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.8 t30 -106.75 103.36 12.78 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.005 -0.543 . . . . 1.24 110.902 -175.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 21.1 mt-10 -119.2 169.47 9.93 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.81 -0.811 . . . . 1.2 108.81 175.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 36.3 t70 78.97 -2.25 2.28 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-O 122.445 1.117 . . . . 0.58 109.443 -176.092 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 23' ' ' SER . 34.8 m -104.0 -173.01 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.054 0 CA-C-N 113.675 -1.602 . . . . 0.25 110.314 -179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.627 ' O ' HG23 ' A' ' 22' ' ' VAL . 75.6 m -72.06 167.63 30.02 Favored Pre-proline 0 C--N 1.316 -0.889 0 N-CA-C 105.23 -2.137 . . . . 1.13 105.23 172.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_exo -41.77 129.06 3.93 Favored 'Trans proline' 0 C--N 1.355 0.917 0 CA-C-N 121.345 1.516 . . . . 0.16 112.577 -144.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.479 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.77 142.64 18.31 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 114.124 -1.398 . . . . 0.1 112.336 -163.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -127.26 169.11 13.86 Favored 'General case' 0 N--CA 1.436 -1.126 0 CA-C-N 114.332 -1.304 . . . . 0.32 111.787 -169.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.718 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -120.75 105.5 10.8 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.803 -1.184 . . . . 0.09 107.803 174.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.9 m -102.48 107.5 18.49 Favored 'General case' 0 C--N 1.308 -1.207 0 CA-C-O 121.072 0.463 . . . . 0.17 111.414 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.406 ' CD2' ' HB3' ' A' ' 9' ' ' PHE . 84.8 t90 -85.17 132.32 34.31 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.222 -0.659 . . . . 0.14 109.222 172.254 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.444 ' HG2' HG23 ' A' ' 37' ' ' VAL . 63.7 mtt180 -125.75 159.37 32.53 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 108.92 -0.77 . . . . 1.91 108.92 173.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 p -69.25 176.44 3.3 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 109.31 -0.626 . . . . 0.6 109.31 178.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.401 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 1.8 p -57.87 -41.39 82.34 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.403 -0.519 . . . . 0.26 111.205 -178.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.86 -32.09 21.89 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.389 -0.597 . . . . 2.12 109.389 171.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.431 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 101.01 17.33 23.16 Favored Glycine 0 N--CA 1.448 -0.538 0 CA-C-N 115.457 -0.792 . . . . 0.23 113.84 172.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.77 -44.36 77.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 117.253 0.526 . . . . 1.73 109.752 174.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.6 tttm -82.98 137.22 34.25 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.644 -0.872 . . . . 1.3 108.644 174.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.444 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.4 p -149.89 138.49 14.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.799 0.333 . . . . 0.17 111.432 -176.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -143.98 126.45 15.88 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.618 -0.512 . . . . 0.41 109.618 176.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 92.2 m -111.64 136.44 50.86 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.135 0.42 . . . . 0.15 112.135 -176.081 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.718 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.37 128.61 57.73 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.704 0 N-CA-C 108.154 -1.054 . . . . 0.12 108.154 169.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.438 ' O ' HG12 ' A' ' 45' ' ' ILE . 70.5 t -92.73 121.62 43.53 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 O-C-N 121.108 -0.995 . . . . 0.11 108.773 173.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.8 -17.08 63.39 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.923 0.712 . . . . 0.08 112.923 -169.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.9 p -72.04 -11.63 60.85 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.205 -0.598 . . . . 0.87 109.557 174.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.9 p -111.4 9.09 21.45 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 115.615 -0.721 . . . . 0.15 109.711 179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.586 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.8 mm -113.33 141.49 28.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 108.963 -0.754 . . . . 0.12 108.963 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -107.08 -44.69 4.32 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 120.982 0.42 . . . . 0.52 110.489 -179.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.598 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 24.5 mtpp -133.0 172.16 13.0 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-O 121.711 0.767 . . . . 1.41 111.895 -175.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.622 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -153.28 138.93 17.84 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 114.332 -1.304 . . . . 0.73 108.284 178.414 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -137.23 118.56 14.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 117.736 0.244 . . . . 1.94 110.914 -173.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.47 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -115.04 141.6 47.77 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 120.715 0.293 . . . . 0.22 111.358 -177.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.47 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 73.3 p -65.68 120.29 67.31 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 115.764 -0.653 . . . . 0.26 111.01 -176.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.538 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 10.4 Cg_exo -60.42 161.51 20.19 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.395 2.063 . . . . 0.38 111.54 176.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.09 -21.48 65.87 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.282 -0.417 . . . . 0.66 110.92 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 12.4 p -78.81 -18.17 54.52 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.917 -0.583 . . . . 1.5 110.614 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.538 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 37.8 m -75.93 139.53 41.64 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.701 -0.681 . . . . 0.85 111.143 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -65.36 -11.92 46.91 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.129 -0.941 . . . . 1.77 110.712 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.445 ' HB3' HG21 ' A' ' 51' ' ' THR . 9.5 mptt -102.5 155.39 18.3 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 114.748 -1.115 . . . . 1.63 111.783 -174.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.47 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 71.9 mmm -130.77 99.38 4.92 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.359 -0.837 . . . . 1.11 109.296 170.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.464 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.6 OUTLIER -156.06 157.65 36.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.751 -0.659 . . . . 0.22 111.674 -173.224 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.588 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.7 tt -132.01 119.31 20.89 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 108.353 -0.98 . . . . 0.1 108.353 176.249 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.444 ' HA ' ' HA ' ' A' ' 88' ' ' MET . 54.9 mtm180 -101.62 140.58 35.72 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 120.849 0.357 . . . . 2.99 111.075 -178.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.933 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -116.72 105.25 12.2 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.429 -0.805 . . . . 0.13 109.403 175.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.598 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.5 mp -86.03 107.78 16.83 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 C-N-CA 122.551 0.34 . . . . 0.29 110.317 -173.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.684 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -62.26 164.11 24.94 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.989 -0.624 . . . . 0.54 112.621 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 74.4 mttt -80.78 157.68 25.69 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.237 0.541 . . . . 0.55 111.687 -179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.597 HG22 ' HG3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -114.28 110.12 30.94 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.666 0 CA-C-N 115.519 -0.764 . . . . 1.73 111.252 -177.492 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.666 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 36.6 m-20 -90.6 78.24 6.29 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 108.569 -0.9 . . . . 3.23 108.569 169.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -68.42 -1.29 6.17 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.128 0.418 . . . . 2.39 112.128 -171.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.0 p -67.33 -17.9 64.95 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.344 0.592 . . . . 2.96 109.789 169.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.666 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -78.65 32.65 0.2 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.41 -0.814 . . . . 2.49 111.183 178.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.417 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 12.0 mmmt -45.67 113.87 0.67 Allowed 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 109.087 -0.708 . . . . 3.4 109.087 -175.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.547 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 36.0 ttm180 -105.55 165.49 11.11 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 115.78 -0.646 . . . . 3.8 109.289 -169.262 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.587 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 96.7 mttt -136.93 140.78 42.51 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.669 -0.493 . . . . 4.29 109.669 173.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -86.26 -165.04 1.14 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.221 -0.445 . . . . 4.41 110.587 -176.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -60.95 -30.83 70.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 5.34 111.317 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -82.95 -21.96 33.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.801 0.334 . . . . 5.38 110.739 -177.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 98.99 14.19 37.35 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 111.139 -0.784 . . . . 4.37 111.139 -175.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.587 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 80.0 m-20 -69.63 132.34 46.03 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 109.23 -0.655 . . . . 4.51 109.23 178.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -70.73 92.91 0.9 Allowed 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.348 -0.612 . . . . 4.28 109.348 179.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.547 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 17.4 m -101.22 98.62 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.176 0 CA-C-O 121.725 0.774 . . . . 3.1 109.418 177.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.8 OUTLIER -85.65 102.69 2.76 Favored Pre-proline 0 C--N 1.314 -0.965 0 N-CA-C 108.366 -0.976 . . . . 2.5 108.366 175.229 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 46.5 Cg_exo -59.39 132.2 44.99 Favored 'Trans proline' 0 CA--C 1.516 -0.39 0 C-N-CA 123.357 2.705 . . . . 1.87 113.478 -165.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.3 ptmm? -73.76 165.45 53.08 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 114.189 -1.369 . . . . 2.74 109.988 178.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.684 ' HB3' ' O ' ' A' ' 64' ' ' GLY . 16.9 Cg_exo -61.23 147.88 94.39 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 121.842 1.695 . . . . 0.84 112.248 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 19.6 mt-30 -91.8 115.64 28.23 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.602 -0.726 . . . . 1.57 109.242 177.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 44.2 mtt-85 -100.21 120.54 40.05 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 115.388 -0.824 . . . . 2.52 110.123 -173.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.559 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 54.9 m-70 -95.48 111.0 22.98 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.432 -0.804 . . . . 0.72 108.96 -177.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.444 ' HA ' ' HA ' ' A' ' 61' ' ' ARG . 30.5 ttm -107.51 125.76 51.68 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 119.795 -0.762 . . . . 0.27 111.254 -176.36 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.4 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.8 m-85 -114.05 129.1 56.63 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.263 -0.88 . . . . 0.27 109.498 177.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.24 149.31 29.08 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.076 0.465 . . . . 1.26 110.275 178.041 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.424 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 23.7 m-85 -132.06 173.81 10.83 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.932 -0.576 . . . . 0.32 110.682 -175.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.595 ' C ' HD22 ' A' ' 93' ' ' ASN . 8.9 t-20 -123.11 -20.89 5.59 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.953 -0.567 . . . . 2.38 110.116 174.617 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.595 HD22 ' C ' ' A' ' 92' ' ' ASN . 0.9 OUTLIER -126.33 123.44 38.03 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.054 0.454 . . . . 1.1 110.786 -177.249 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.526 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 15.4 mmm180 -60.77 -33.31 72.76 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.504 -0.771 . . . . 3.09 112.654 179.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.8 m -64.38 -37.96 89.36 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.786 0.327 . . . . 0.35 110.819 -178.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.626 ' O ' HG12 ' A' ' 100' ' ' ILE . 15.4 t -66.23 -56.19 15.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.367 0 CA-C-N 116.299 -0.41 . . . . 0.23 110.489 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.588 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.8 ptp -57.24 -39.28 75.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.97 -0.559 . . . . 0.17 110.828 -178.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.482 ' N ' ' HG3' ' A' ' 97' ' ' MET . 32.4 t70 -66.63 -41.06 88.91 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 120.722 -0.391 . . . . 0.34 110.451 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.404 ' OD1' ' HA ' ' A' ' 1' ' ' PRO . 1.4 t-20 -69.22 -44.11 72.72 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 123.114 0.259 . . . . 1.36 111.08 179.586 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.635 HG22 HD11 ' A' ' 104' ' ' LEU . 31.7 mm -61.09 -57.76 10.67 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.452 0 N-CA-C 108.81 -0.811 . . . . 0.12 108.81 177.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.803 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.5 ttpt -50.83 -48.39 59.91 Favored 'General case' 0 C--O 1.215 -0.75 0 O-C-N 123.927 0.767 . . . . 0.79 109.863 177.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.704 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 41.5 ttp -49.09 -56.99 7.38 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.716 -0.674 . . . . 0.28 111.077 177.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.732 ' O ' HG13 ' A' ' 107' ' ' ILE . 26.0 m -58.72 -51.96 67.73 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.468 0.48 . . . . 0.18 110.473 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.933 HD13 HD21 ' A' ' 62' ' ' LEU . 29.1 mt -48.48 -54.03 15.76 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 123.451 0.701 . . . . 0.09 110.613 175.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.58 ' HG2' HD13 ' A' ' 48' ' ' LEU . 44.9 mt-30 -50.56 -44.99 56.83 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.701 -1.136 . . . . 1.2 111.825 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.704 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.9 mt-30 -63.29 -42.21 99.06 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 122.001 0.905 . . . . 2.37 108.986 -179.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.732 HG13 ' O ' ' A' ' 103' ' ' THR . 10.2 mt -66.1 -45.98 89.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-N 114.1 -1.409 . . . . 0.15 111.311 -178.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.508 HD12 HD11 ' A' ' 48' ' ' LEU . 9.0 mt -64.21 -40.77 90.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 116.218 -0.446 . . . . 0.19 111.493 -178.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 33.4 t -58.54 -23.3 57.98 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.383 -0.371 . . . . 1.14 110.965 -178.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 83.4 mtt180 -66.1 -52.14 51.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.427 0.632 . . . . 1.64 109.652 174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -79.01 -11.67 60.01 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.475 -0.784 . . . . 0.65 110.441 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.95 -40.51 75.41 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 108.747 -0.834 . . . . 0.76 108.747 173.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -74.05 -39.55 63.44 Favored 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.327 -0.851 . . . . 2.27 109.98 175.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -95.17 55.49 1.79 Allowed 'General case' 0 N--CA 1.44 -0.957 0 CA-C-N 115.134 -0.939 . . . . 1.2 110.478 -177.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 32.1 t70 . . . . . 0 C--O 1.248 0.997 0 CA-C-N 115.445 -0.798 . . . . 2.72 110.897 -177.777 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.642 0 N-CA-C 111.898 -0.481 . . . . 19.89 111.898 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 24.9 m -121.12 95.72 48.63 Favored Pre-proline 0 C--N 1.323 -0.564 0 N-CA-C 109.889 -0.412 . . . . 18.33 109.889 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -73.65 -12.05 24.36 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 123.162 2.575 . . . . 17.39 113.99 -174.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -147.29 141.94 9.8 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.063 -1.065 . . . . 16.36 113.047 -177.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -129.6 87.33 53.13 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.759 -0.46 . . . . 16.0 109.759 176.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_exo -59.82 -57.32 0.85 Allowed 'Trans proline' 0 C--O 1.233 0.225 0 C-N-CA 122.97 2.447 . . . . 13.15 112.396 -179.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 54.58 65.69 1.44 Allowed 'General case' 0 N--CA 1.466 0.333 0 O-C-N 123.568 0.543 . . . . 12.36 111.583 178.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -147.17 -74.25 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.55 0 C-N-CA 120.893 -0.67 . . . . 9.63 111.792 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.468 ' N ' HD13 ' B' ' 527' ' ' LEU . 0.0 OUTLIER -132.44 29.17 4.28 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.73 0.3 . . . . 8.34 111.217 177.303 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 2.7 tt -73.08 85.24 1.32 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 108.957 -0.757 . . . . 10.41 108.957 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 66.7 m 60.85 63.57 1.27 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.652 -0.704 . . . . 7.62 110.122 -177.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -59.82 -63.33 5.18 Favored Glycine 0 N--CA 1.449 -0.481 0 CA-C-N 115.13 -0.941 . . . . 5.19 112.514 -177.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -158.25 -41.55 0.06 Allowed 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 121.751 0.786 . . . . 5.5 110.409 -179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -80.09 -45.21 18.65 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 114.637 -1.165 . . . . 5.68 109.956 -176.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -72.58 -26.31 61.66 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 113.171 -1.831 . . . . 3.22 110.074 177.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 21.8 t80 -75.63 -45.3 38.14 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.374 -0.83 . . . . 4.27 110.702 -176.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 7.8 p -65.67 -30.6 71.32 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.882 -0.599 . . . . 1.25 111.269 -177.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 18.2 m -71.49 -36.34 71.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 2.08 111.029 177.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . 0.454 HD13 ' HA ' ' B' ' 537' ' ' ILE . 7.5 mm -77.64 -37.53 24.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.897 0.38 . . . . 1.29 110.868 175.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -75.15 5.58 5.23 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.6 0.714 . . . . 0.76 110.934 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -69.68 -40.04 76.6 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.113 -0.949 . . . . 1.23 108.718 167.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 50.7 mtm -67.08 -29.7 69.54 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 114.869 -1.059 . . . . 2.29 110.036 174.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -67.3 -53.75 26.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.515 0.674 . . . . 1.18 109.836 176.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.407 ' HA ' HD12 ' B' ' 545' ' ' LEU . 0.1 OUTLIER -63.56 -34.32 77.55 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 114.692 -1.14 . . . . 0.56 111.322 -173.611 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 22.5 t -64.1 -24.21 67.61 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.028 -0.533 . . . . 1.58 110.737 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -91.5 -14.47 30.37 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.995 0.426 . . . . 0.84 110.802 177.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.419 HD11 ' HD3' ' A' ' 57' ' ' LYS . 78.2 mt -82.18 -40.29 21.97 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.229 -0.442 . . . . 1.08 111.498 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 20.8 mt -76.26 -22.08 55.55 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.274 0.559 . . . . 0.97 110.026 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 36.1 p -96.96 33.38 1.91 Allowed 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.291 -0.868 . . . . 1.42 111.554 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -76.8 44.8 0.39 Allowed 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.393 0.616 . . . . 2.67 110.543 175.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 26.2 pt -102.5 3.86 10.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 115.617 -0.72 . . . . 5.23 110.94 -175.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 22.9 m -102.71 14.54 31.69 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.263 0.554 . . . . 6.4 110.214 179.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 C--O 1.248 0.987 0 CA-C-N 115.518 -0.765 . . . . 7.59 109.686 177.756 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo . . . . . 0 N--CA 1.479 0.658 0 N-CA-C 111.191 -0.35 . . . . 1.89 111.191 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.2 t -160.04 105.79 1.56 Allowed 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 109.012 -0.736 . . . . 2.05 109.012 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.517 ' HA ' HD12 ' A' ' 18' ' ' ILE . 76.4 m80 -95.68 1.37 53.48 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.023 -0.535 . . . . 0.75 110.734 -178.647 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 t -152.53 149.08 28.12 Favored 'General case' 0 C--N 1.317 -0.825 0 C-N-CA 118.885 -1.126 . . . . 1.09 113.928 -170.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.489 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -169.28 -172.13 35.65 Favored Glycine 0 N--CA 1.439 -1.111 0 CA-C-N 113.668 -1.605 . . . . 0.16 109.745 177.201 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.41 ' HB3' HD21 ' A' ' 92' ' ' ASN . . . -91.53 132.38 36.32 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 117.834 0.817 . . . . 0.16 110.323 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.466 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -144.12 146.6 32.89 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.196 -0.456 . . . . 0.11 111.435 -177.728 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.558 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 98.3 mt -107.47 123.75 62.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.281 -0.418 . . . . 0.33 110.706 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.424 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.0 t80 -127.19 137.54 52.95 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.305 -0.998 . . . . 0.36 108.305 177.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 58.35 26.24 13.8 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 122.775 0.43 . . . . 0.8 110.919 -178.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.4 mtmm 68.61 0.08 2.49 Favored 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.521 0.728 . . . . 2.11 112.915 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.424 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.6 OUTLIER -92.4 116.82 34.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 108.53 -0.915 . . . . 0.22 108.53 169.014 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.446 ' HA ' HG12 ' A' ' 8' ' ' ILE . 50.2 p -70.92 145.18 50.31 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.114 0.483 . . . . 1.07 110.791 -176.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.0 -160.42 10.7 Favored Glycine 0 N--CA 1.436 -1.366 0 C-N-CA 120.297 -0.954 . . . . 0.11 113.087 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 23.0 mm -125.27 132.28 71.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.122 -0.695 . . . . 0.13 109.122 -178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.56 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -100.82 136.1 33.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 N-CA-C 109.856 -0.424 . . . . 0.13 109.856 -176.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.9 125.83 24.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.921 0.391 . . . . 0.1 111.523 -179.689 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.551 HG12 HD23 ' A' ' 27' ' ' LEU . 74.5 mt -85.28 132.8 30.92 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 109.779 -0.452 . . . . 0.27 109.779 177.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -102.98 102.29 12.33 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.967 -0.56 . . . . 1.24 110.792 -174.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 13.5 mt-10 -116.02 170.16 8.7 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.256 -0.646 . . . . 1.2 109.256 176.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.447 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 35.5 t70 78.21 -4.59 2.18 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 122.394 1.092 . . . . 0.58 109.704 -176.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.672 HG23 ' O ' ' A' ' 23' ' ' SER . 32.5 m -103.15 -172.49 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-N 113.765 -1.561 . . . . 0.25 110.028 -179.575 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.672 ' O ' HG23 ' A' ' 22' ' ' VAL . 58.2 m -72.89 169.65 16.65 Favored Pre-proline 0 C--N 1.315 -0.898 0 N-CA-C 105.686 -1.968 . . . . 1.13 105.686 173.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_exo -41.96 129.21 4.19 Favored 'Trans proline' 0 C--N 1.359 1.126 0 CA-C-N 121.538 1.585 . . . . 0.16 112.328 -145.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.473 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -55.97 141.99 37.52 Favored 'General case' 0 CA--C 1.506 -0.746 0 CA-C-N 114.262 -1.335 . . . . 0.1 112.051 -161.445 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -123.47 168.94 11.9 Favored 'General case' 0 N--CA 1.438 -1.062 0 CA-C-N 114.568 -1.196 . . . . 0.32 111.915 -169.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.76 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -120.08 105.28 10.86 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 107.69 -1.226 . . . . 0.09 107.69 173.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.415 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.2 m -100.91 106.81 18.19 Favored 'General case' 0 C--N 1.308 -1.217 0 CA-C-N 116.554 -0.294 . . . . 0.17 110.854 -176.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.41 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 83.8 t90 -85.07 130.41 34.62 Favored 'General case' 0 N--CA 1.445 -0.681 0 N-CA-C 108.98 -0.748 . . . . 0.14 108.98 171.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.5 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 58.0 mtt180 -126.46 155.2 42.62 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.067 -0.716 . . . . 1.91 109.067 174.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -69.0 176.19 3.29 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 109.634 -0.506 . . . . 0.6 109.634 178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.7 p -61.24 -32.42 72.21 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.224 -0.59 . . . . 0.26 110.272 177.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -86.65 -31.64 20.98 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.674 0.749 . . . . 2.12 108.981 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.5 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 88.62 9.97 68.16 Favored Glycine 0 N--CA 1.447 -0.618 0 CA-C-N 114.573 -1.194 . . . . 0.23 112.498 176.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -64.14 -48.42 76.13 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.795 -0.817 . . . . 1.73 108.795 173.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -77.35 136.1 38.42 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.284 -0.871 . . . . 1.3 109.134 173.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.456 HG23 ' HG2' ' A' ' 30' ' ' ARG . 11.6 p -150.15 139.24 15.3 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 120.739 0.304 . . . . 0.17 111.089 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.6 t60 -144.47 121.43 11.35 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.659 -0.497 . . . . 0.41 109.659 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 32.3 m -109.47 133.23 53.34 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 112.194 0.442 . . . . 0.15 112.194 -175.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.76 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.11 129.23 53.81 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.702 0 N-CA-C 108.253 -1.017 . . . . 0.12 108.253 169.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 62.4 t -92.92 121.77 43.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 O-C-N 121.036 -1.04 . . . . 0.11 108.769 173.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.558 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.67 -20.88 64.46 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 113.151 0.797 . . . . 0.08 113.151 -169.115 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 4.1 p -68.62 -14.56 63.09 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.159 -0.616 . . . . 0.87 109.735 174.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.3 p -111.1 14.86 21.84 Favored 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 115.568 -0.742 . . . . 0.15 109.703 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.541 HG21 HD13 ' A' ' 62' ' ' LEU . 24.1 mm -113.08 138.73 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 CA-C-N 115.641 -0.709 . . . . 0.12 109.217 176.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -104.15 -40.53 6.12 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.204 -0.453 . . . . 0.52 110.51 -176.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.455 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 11.2 mtmm -141.62 170.64 15.33 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.325 -0.398 . . . . 1.41 110.93 -177.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.616 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -149.69 141.66 23.84 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.498 -0.927 . . . . 0.73 108.498 176.871 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.5 ' HB3' HD11 ' B' ' 546' ' ' LEU . 18.0 mm-40 -136.77 114.7 11.38 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 117.362 0.074 . . . . 1.94 111.069 -171.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.45 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -113.34 142.72 45.53 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.98 -0.45 . . . . 0.22 111.229 -179.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.58 ' N ' ' HZ ' ' B' ' 542' ' ' PHE . 34.8 p -62.01 122.32 71.44 Favored Pre-proline 0 N--CA 1.463 0.187 0 CA-C-N 115.822 -0.626 . . . . 0.26 110.985 -176.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.521 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 15.1 Cg_exo -59.21 159.6 21.97 Favored 'Trans proline' 0 N--CA 1.46 -0.46 0 C-N-CA 122.554 2.169 . . . . 0.38 111.303 177.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.19 -14.81 63.26 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.092 -0.504 . . . . 0.66 110.857 -179.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 11.7 p -85.84 -17.19 36.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.631 -0.713 . . . . 1.5 110.845 176.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.521 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 45.2 m -78.73 135.67 37.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.717 -0.674 . . . . 0.85 111.133 -179.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -56.44 -34.44 66.84 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-N 115.333 -0.849 . . . . 1.77 110.061 172.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.483 ' HB3' HG21 ' A' ' 51' ' ' THR . 8.3 mptt -76.25 152.12 36.61 Favored 'General case' 0 N--CA 1.431 -1.38 0 CA-C-N 113.992 -1.458 . . . . 1.63 111.927 -174.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.445 ' HB3' ' HE3' ' A' ' 58' ' ' MET . 85.7 mmm -129.48 98.55 4.89 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.304 -0.862 . . . . 1.11 108.691 171.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.479 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.1 OUTLIER -154.07 153.84 32.6 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.882 -0.599 . . . . 0.22 111.53 -172.069 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.8 tt -130.33 118.91 21.99 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.342 -0.984 . . . . 0.1 108.342 177.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.655 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 1.6 mtp180 -103.41 149.21 25.02 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.458 0.647 . . . . 2.99 111.775 -178.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.934 HD21 HD13 ' A' ' 104' ' ' LEU . 1.4 mm? -127.65 104.98 8.16 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.38 -1.282 . . . . 0.13 108.901 -179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.538 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -88.3 105.0 15.16 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 110.196 -0.298 . . . . 0.29 110.196 -173.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.573 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -62.69 160.45 33.37 Favored Glycine 0 N--CA 1.448 -0.559 0 CA-C-N 116.181 -0.463 . . . . 0.54 112.464 179.132 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.2 mttt -81.62 115.04 20.71 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-O 121.654 0.74 . . . . 0.55 112.664 -177.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.62 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 2.3 t -122.35 133.2 69.32 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.084 0 CA-C-N 114.465 -1.243 . . . . 1.73 109.65 170.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.78 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 20.9 t70 -89.5 87.87 7.23 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 115.701 -0.681 . . . . 3.23 109.208 178.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -64.61 -4.52 4.23 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 112.865 0.691 . . . . 2.39 112.865 -170.746 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.57 -1.65 47.1 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.092 0.472 . . . . 2.96 110.673 172.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.78 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.2 ptmt -81.39 40.14 0.55 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.92 -0.582 . . . . 2.49 110.331 172.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.494 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 25.1 mmtm -43.53 114.32 0.62 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.705 -0.68 . . . . 3.4 110.665 -173.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 44.9 ttt180 -95.57 162.92 13.43 Favored 'General case' 0 N--CA 1.437 -1.106 0 N-CA-C 108.093 -1.077 . . . . 3.8 108.093 -175.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.579 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 20.0 mtpt -128.29 132.81 48.67 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 109.182 -0.673 . . . . 4.29 109.182 172.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -77.37 -171.92 2.29 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.63 -0.713 . . . . 4.41 110.696 -174.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -59.52 -32.05 69.94 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.775 0.287 . . . . 5.34 111.775 -177.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.506 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 25.0 mt-10 -83.71 -19.06 35.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.031 0.443 . . . . 5.38 110.926 -179.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.434 ' O ' ' HE2' ' A' ' 73' ' ' LYS . . . 95.89 31.19 7.48 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-N 115.953 -0.567 . . . . 4.37 112.753 178.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.579 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 39.7 m-80 -92.35 148.17 22.34 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.046 -0.724 . . . . 4.51 109.046 175.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -72.55 89.38 1.28 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.11 0.481 . . . . 4.28 109.778 -179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.578 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 12.3 m -99.36 99.31 8.31 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.983 0 CA-C-O 121.884 0.849 . . . . 3.1 109.076 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.494 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.4 OUTLIER -85.22 119.38 72.33 Favored Pre-proline 0 C--N 1.31 -1.121 0 CA-C-N 115.601 -0.727 . . . . 2.5 109.994 -178.597 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 52.8 Cg_exo -58.25 140.93 96.18 Favored 'Trans proline' 0 CA--C 1.513 -0.573 0 C-N-CA 122.638 2.225 . . . . 1.87 112.274 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.73 148.6 35.1 Favored Pre-proline 0 C--N 1.314 -0.948 0 CA-C-N 115.587 -0.733 . . . . 2.74 109.156 177.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.62 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 22.8 Cg_exo -62.73 148.22 93.68 Favored 'Trans proline' 0 N--CA 1.456 -0.732 0 C-N-CA 122.249 1.966 . . . . 0.84 110.686 176.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -84.26 114.39 21.8 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 121.6 0.714 . . . . 1.57 109.944 -176.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.516 ' HG2' HG13 ' A' ' 63' ' ' ILE . 90.3 mtt180 -104.15 121.75 43.9 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 115.182 -0.917 . . . . 2.52 110.497 -172.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.561 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 80.3 m-70 -94.76 146.28 24.28 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 107.415 -1.328 . . . . 0.72 107.415 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.655 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 8.1 ttm -141.1 125.49 17.6 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 119.049 0.84 . . . . 0.27 110.931 176.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.466 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.6 m-85 -116.84 127.95 54.79 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.356 -0.838 . . . . 0.27 109.654 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.558 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -80.93 150.72 28.88 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-O 120.717 0.294 . . . . 1.26 110.356 178.222 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.435 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 28.2 m-85 -133.46 175.47 9.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.515 0.674 . . . . 0.32 111.649 -174.044 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.41 HD21 ' HB3' ' A' ' 6' ' ' ALA . 2.6 p30 -111.24 -29.44 7.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.952 -1.022 . . . . 2.38 110.998 178.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -138.13 142.89 40.15 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.003 0.43 . . . . 1.1 110.502 -177.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.61 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 11.0 mmm180 -64.99 -34.23 77.94 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.48 -0.782 . . . . 3.09 111.011 179.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 57.0 m -58.74 -39.28 80.45 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.115 -0.493 . . . . 0.35 110.626 -176.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.57 ' O ' HG12 ' A' ' 100' ' ' ILE . 9.7 t -67.15 -55.91 15.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.184 -0.462 . . . . 0.23 110.026 177.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.61 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 14.0 ptp -61.86 -41.34 97.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.17 111.237 -177.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.434 ' N ' ' HG3' ' A' ' 97' ' ' MET . 36.4 t70 -62.34 -37.1 84.36 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.394 -0.522 . . . . 0.34 110.504 178.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 18.4 m-20 -74.08 -43.46 57.62 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 116.332 -0.395 . . . . 1.36 111.618 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.57 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.8 mm -63.71 -55.02 24.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.317 0 N-CA-C 108.962 -0.755 . . . . 0.12 108.962 176.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.875 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.8 ttpt -51.53 -45.48 62.98 Favored 'General case' 0 C--O 1.217 -0.609 0 O-C-N 123.574 0.546 . . . . 0.79 109.783 177.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.624 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 38.8 ttp -50.91 -59.8 3.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.839 -0.619 . . . . 0.28 111.308 177.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.794 ' O ' HG13 ' A' ' 107' ' ' ILE . 27.6 m -56.5 -49.77 73.75 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 123.471 0.482 . . . . 0.18 110.263 -179.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.934 HD13 HD21 ' A' ' 62' ' ' LEU . 30.9 mt -48.48 -55.32 11.28 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 123.026 0.53 . . . . 0.09 110.579 174.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.547 ' HG2' HD13 ' A' ' 48' ' ' LEU . 45.0 mt-30 -54.22 -42.41 69.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.141 -0.936 . . . . 1.2 111.712 176.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.624 ' HG3' ' O ' ' A' ' 102' ' ' MET . 21.4 mt-30 -64.71 -28.64 69.73 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.769 0.795 . . . . 2.37 109.457 -179.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.794 HG13 ' O ' ' A' ' 103' ' ' THR . 10.7 mt -84.52 -45.34 17.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 114.672 -1.149 . . . . 0.15 111.232 -177.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.541 HD12 HD11 ' A' ' 48' ' ' LEU . 9.8 mt -63.24 -38.81 83.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.28 -0.418 . . . . 0.19 111.582 -177.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.424 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 4.7 p -57.75 -26.87 62.44 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.41 -0.359 . . . . 1.14 111.351 -179.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 80.1 mtt180 -62.6 -47.18 84.91 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.413 0.625 . . . . 1.64 109.557 174.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -89.67 8.18 32.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.548 -0.751 . . . . 0.65 110.186 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.424 ' CB ' ' HA ' ' A' ' 109' ' ' SER . 0.0 OUTLIER -95.53 -16.56 22.09 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.631 -0.877 . . . . 0.76 108.631 176.07 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -75.5 -37.66 60.02 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 107.977 -1.119 . . . . 2.27 107.977 167.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -74.23 -23.69 59.2 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 113.978 -1.464 . . . . 1.2 110.605 -179.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.424 ' OD2' ' HE2' ' A' ' 65' ' ' LYS . 9.0 t70 . . . . . 0 C--O 1.248 0.978 0 CA-C-N 114.637 -1.165 . . . . 2.72 110.371 -178.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.775 0 N-CA-C 111.959 -0.457 . . . . 19.89 111.959 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 43.8 t -94.9 123.31 58.02 Favored Pre-proline 0 C--N 1.325 -0.474 0 CA-C-N 116.627 0.214 . . . . 18.33 110.468 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -81.65 6.17 5.82 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.761 2.308 . . . . 17.39 111.757 175.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 92.97 157.78 33.81 Favored Glycine 0 N--CA 1.445 -0.756 0 CA-C-N 115.773 -0.649 . . . . 16.36 111.688 -177.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -117.78 95.82 48.52 Favored Pre-proline 0 C--N 1.323 -0.571 0 CA-C-O 120.522 0.201 . . . . 16.0 110.709 -178.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -72.2 151.25 54.68 Favored 'Trans proline' 0 C--O 1.234 0.302 0 C-N-CA 122.49 2.126 . . . . 13.15 111.615 178.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -94.16 143.8 26.06 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.445 -0.343 . . . . 12.36 110.95 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -93.59 50.58 2.34 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.813 -0.708 . . . . 9.63 111.927 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 2.7 pp -139.14 122.09 16.68 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.094 0.473 . . . . 8.34 110.131 -179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . 0.411 ' H ' ' HB2' ' B' ' 533' ' ' ASP . 44.3 tp -98.53 -8.58 26.32 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 107.554 -1.276 . . . . 10.41 107.554 167.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . 0.49 ' OG ' ' HB2' ' B' ' 532' ' ' GLU . 25.0 p -172.69 -31.99 0.01 OUTLIER 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 112.939 -1.937 . . . . 7.62 107.314 178.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 150.48 -74.88 0.26 Allowed Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 114.912 -1.04 . . . . 5.19 112.828 168.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -99.15 -10.85 21.97 Favored 'General case' 0 CA--C 1.509 -0.611 0 CA-C-O 122.204 1.002 . . . . 5.5 108.905 -174.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . 0.545 ' HA ' ' OG ' ' B' ' 535' ' ' SER . 49.4 mt-10 -90.01 4.88 48.84 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 114.034 -1.439 . . . . 5.68 110.361 -178.529 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . 0.429 ' O ' ' HB3' ' B' ' 536' ' ' SER . 13.2 t70 -89.87 -43.81 10.36 Favored 'General case' 0 C--N 1.311 -1.1 0 CA-C-N 114.063 -1.426 . . . . 3.22 109.949 178.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -66.51 -39.61 88.76 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.689 0.757 . . . . 4.27 109.667 176.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . 0.545 ' OG ' ' HA ' ' B' ' 532' ' ' GLU . 9.4 p -71.63 -11.13 60.69 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.949 -1.023 . . . . 1.25 110.496 176.41 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . 0.495 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 26.4 t -75.2 -27.52 59.63 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.17 0.51 . . . . 2.08 109.781 176.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . 0.441 ' O ' ' HB2' ' B' ' 540' ' ' MET . 22.2 mm -80.93 -31.14 12.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 109.476 -0.564 . . . . 1.29 109.476 172.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -76.18 -3.14 34.67 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.723 0.773 . . . . 0.76 110.097 172.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' B' ' 536' ' ' SER . 22.2 t70 -80.69 -32.53 35.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 114.978 -1.01 . . . . 1.23 108.725 173.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . 0.441 ' HB2' ' O ' ' B' ' 537' ' ' ILE . 84.5 mmm -57.83 -30.13 65.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.359 -1.291 . . . . 2.29 110.41 176.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -62.24 -43.83 97.95 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.33 -0.85 . . . . 1.18 110.408 176.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.58 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -63.52 -34.33 77.56 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.229 -0.896 . . . . 0.56 111.52 -173.479 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 16.9 t -60.28 -29.18 68.65 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.759 -0.655 . . . . 1.58 110.806 -177.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -85.27 -18.84 32.73 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.318 -0.401 . . . . 0.84 111.027 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 92.2 mt -84.12 -41.95 16.55 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.965 0.412 . . . . 1.08 111.611 -177.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . 0.5 HD11 ' HB3' ' A' ' 49' ' ' GLN . 18.1 mt -76.86 -22.36 53.62 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.238 0.542 . . . . 0.97 110.522 -178.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 19.4 m -89.54 -61.24 1.74 Allowed 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.341 -0.845 . . . . 1.42 110.42 176.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 41.4 mt-30 47.84 56.74 6.78 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.325 0.583 . . . . 2.67 111.744 -177.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 1.4 tp -103.08 -37.81 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.058 0 CA-C-N 115.583 -0.735 . . . . 5.23 109.725 175.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 17.0 m -119.53 40.3 3.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.025 -0.534 . . . . 6.4 110.603 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 33.8 m . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.706 -0.664 . . . . 7.59 110.572 -177.411 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo . . . . . 0 N--CA 1.472 0.255 0 N-CA-C 110.992 -0.426 . . . . 1.89 110.992 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.8 m -69.84 -28.19 65.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.044 -0.525 . . . . 2.05 111.409 -177.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.623 ' HA ' HD12 ' A' ' 18' ' ' ILE . 77.8 m80 65.07 -3.21 0.63 Allowed 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 112.835 0.68 . . . . 0.75 112.835 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.3 t -156.74 159.17 38.07 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 119.773 -0.771 . . . . 1.09 112.131 -174.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.526 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.18 -168.82 39.78 Favored Glycine 0 N--CA 1.438 -1.198 0 CA-C-N 114.478 -1.237 . . . . 0.16 110.099 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.7 131.93 39.99 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 117.49 0.645 . . . . 0.16 110.398 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.434 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -142.36 144.82 33.35 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.133 0.492 . . . . 0.11 111.561 -177.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . . . . . . . . . 79.6 mt -111.52 119.45 59.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 115.883 -0.599 . . . . 0.33 110.258 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -120.65 137.37 54.49 Favored 'General case' 0 C--N 1.314 -0.968 0 N-CA-C 108.717 -0.846 . . . . 0.36 108.717 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 54.74 26.57 7.73 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 122.737 0.415 . . . . 0.8 111.019 -178.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp 68.37 5.34 4.7 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.825 0.676 . . . . 2.11 112.825 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.5 p -94.9 116.54 36.49 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 108.216 -1.031 . . . . 0.22 108.216 166.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 28.9 m -73.0 144.71 47.11 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.023 0.439 . . . . 1.07 111.077 -175.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.0 -158.43 9.32 Favored Glycine 0 N--CA 1.437 -1.257 0 C-N-CA 120.686 -0.769 . . . . 0.11 112.803 -178.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -125.95 134.62 66.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.184 -0.673 . . . . 0.13 109.184 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.586 HD11 HD11 ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.14 135.34 39.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 109.983 -0.377 . . . . 0.13 109.983 -177.053 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.75 127.86 27.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.948 0.404 . . . . 0.1 111.518 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.623 HD12 ' HA ' ' A' ' 3' ' ' HIS . 65.6 mt -86.02 133.75 28.91 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.169 -0.469 . . . . 0.27 109.94 177.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -106.31 102.01 11.45 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.822 -0.626 . . . . 1.24 110.784 -174.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -116.28 169.35 9.36 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.189 -0.671 . . . . 1.2 109.189 175.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 33.9 t70 76.7 -2.23 2.73 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-O 122.413 1.101 . . . . 0.58 109.737 -176.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 23' ' ' SER . 33.3 m -103.47 -173.71 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 113.743 -1.572 . . . . 0.25 109.959 179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.644 ' O ' HG23 ' A' ' 22' ' ' VAL . 59.5 m -72.96 168.56 23.48 Favored Pre-proline 0 C--N 1.316 -0.874 0 N-CA-C 105.306 -2.109 . . . . 1.13 105.306 173.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.707 ' HB3' ' OG ' ' A' ' 43' ' ' SER . 72.9 Cg_exo -40.7 128.32 2.58 Favored 'Trans proline' 0 C--N 1.356 0.941 0 CA-C-N 121.55 1.589 . . . . 0.16 112.821 -143.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.86 140.08 25.36 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 114.357 -1.292 . . . . 0.1 112.039 -164.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -126.47 168.92 13.56 Favored 'General case' 0 N--CA 1.436 -1.133 0 CA-C-N 114.597 -1.183 . . . . 0.32 112.076 -168.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.76 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -120.25 104.24 9.9 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 107.375 -1.343 . . . . 0.09 107.375 174.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.7 m -101.69 107.87 19.23 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-O 121.07 0.462 . . . . 0.17 111.116 -176.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -85.1 131.78 34.4 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 108.973 -0.751 . . . . 0.14 108.973 172.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.487 ' HG2' HG23 ' A' ' 37' ' ' VAL . 96.3 mtt180 -126.2 158.15 36.38 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.156 -0.683 . . . . 1.91 109.156 173.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.8 p -69.73 174.55 5.02 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.226 -0.657 . . . . 0.6 109.226 178.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 16.6 p -60.96 -35.52 76.97 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 119.93 -0.708 . . . . 0.26 110.504 178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -85.58 -29.34 24.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.613 0.721 . . . . 2.12 109.5 173.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.458 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 90.78 16.76 54.08 Favored Glycine 0 N--CA 1.447 -0.571 0 CA-C-N 114.843 -1.072 . . . . 0.23 112.68 175.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -69.1 -51.41 38.82 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.954 -0.758 . . . . 1.73 108.954 173.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 31.8 tttt -75.72 136.01 40.35 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 108.9 -0.778 . . . . 1.3 108.9 173.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.487 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.0 p -149.75 134.82 10.37 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 120.826 0.346 . . . . 0.17 111.047 -177.095 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -143.87 121.09 11.53 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.977 -0.379 . . . . 0.41 109.977 179.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.411 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 60.9 m -111.04 137.05 49.15 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 112.365 0.505 . . . . 0.15 112.365 -174.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.76 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -104.85 130.18 56.27 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.668 0 N-CA-C 108.392 -0.966 . . . . 0.12 108.392 170.559 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.0 t -92.55 119.7 40.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 O-C-N 121.005 -1.059 . . . . 0.11 108.854 173.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.62 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -67.05 -22.82 65.85 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 112.662 0.615 . . . . 0.08 112.662 -170.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.707 ' OG ' ' HB3' ' A' ' 24' ' ' PRO . 9.7 m -63.87 -18.39 64.12 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.57 0.7 . . . . 0.87 109.482 175.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.1 p -113.72 17.83 17.87 Favored 'General case' 0 N--CA 1.444 -0.77 0 CA-C-N 115.164 -0.925 . . . . 0.15 110.034 -177.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.551 HD13 ' HA2' ' A' ' 64' ' ' GLY . 23.9 mm -113.95 140.82 32.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 108.896 -0.779 . . . . 0.12 108.896 176.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -102.4 -43.48 5.66 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.897 0.379 . . . . 0.52 110.555 -176.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.476 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 17.2 mtmm -141.81 173.04 11.88 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.086 -0.507 . . . . 1.41 110.988 -177.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.637 HD11 HD12 ' A' ' 108' ' ' ILE . 0.0 OUTLIER -151.57 148.63 28.24 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.621 -0.718 . . . . 0.73 109.148 179.833 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.683 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 0.0 OUTLIER -133.6 153.22 51.83 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 110.391 -0.226 . . . . 1.94 110.391 -174.872 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.438 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -150.46 140.18 21.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.642 0.258 . . . . 0.22 110.785 176.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.457 HG21 ' HB3' ' A' ' 57' ' ' LYS . 40.9 p -66.3 118.06 49.52 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.614 -0.721 . . . . 0.26 110.653 -177.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.412 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 12.7 Cg_exo -57.0 159.31 15.03 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.761 2.307 . . . . 0.38 111.897 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.44 -15.92 63.71 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.195 -0.457 . . . . 0.66 111.316 -178.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 48.7 m -83.53 -18.57 37.97 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.232 0.539 . . . . 1.5 110.998 175.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.412 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 73.2 m -79.29 138.31 37.7 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.492 -0.776 . . . . 0.85 111.585 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -62.3 -30.89 71.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 CA-C-N 115.244 -0.889 . . . . 1.77 110.317 174.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.564 ' HE3' ' OD2' ' B' ' 541' ' ' ASP . 1.9 mptp? -77.35 153.01 34.18 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 114.183 -1.371 . . . . 1.63 111.64 -175.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.424 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 1.0 OUTLIER -129.3 98.5 4.9 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.886 -1.052 . . . . 1.11 108.639 172.052 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.472 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.1 OUTLIER -154.64 159.7 40.97 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.351 0.595 . . . . 0.22 111.878 -173.687 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.525 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -140.96 119.31 12.17 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.69 -1.141 . . . . 0.1 108.416 178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.683 ' HB2' ' HB2' ' A' ' 49' ' ' GLN . 25.5 mtp180 -103.7 136.68 42.95 Favored 'General case' 0 C--O 1.218 -0.578 0 CA-C-O 121.285 0.565 . . . . 2.99 110.863 -179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.914 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -111.51 104.39 12.8 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 115.601 -0.727 . . . . 0.13 109.197 176.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.55 HG13 ' HG2' ' A' ' 86' ' ' ARG . 1.7 mp -86.53 101.85 11.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 109.946 -0.39 . . . . 0.29 109.946 -174.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.551 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -61.49 163.97 21.45 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.783 -0.644 . . . . 0.54 112.784 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.526 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 82.0 mttt -85.2 108.94 17.97 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-O 121.954 0.883 . . . . 0.55 112.816 -177.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.552 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 11.9 t -124.68 127.3 72.69 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.611 0 CA-C-N 114.067 -1.424 . . . . 1.73 108.703 165.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.652 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 1.9 t70 -95.06 91.34 6.3 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 108.577 -0.897 . . . . 3.23 108.577 176.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -61.6 -7.61 3.51 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.881 0.697 . . . . 2.39 112.881 -168.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 82.6 p -64.49 -19.47 65.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.306 0.574 . . . . 2.96 109.567 172.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.652 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.1 ptmt -76.41 40.49 0.22 Allowed 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.382 -0.826 . . . . 2.49 110.978 177.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.506 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 19.4 mmtm -44.21 113.48 0.54 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.508 -0.553 . . . . 3.4 109.508 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.625 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 50.4 ttt180 -94.97 156.23 16.41 Favored 'General case' 0 N--CA 1.436 -1.127 0 N-CA-C 108.733 -0.84 . . . . 3.8 108.733 -174.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -130.36 134.62 47.3 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-O 121.333 0.587 . . . . 4.29 110.753 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -74.98 174.0 9.92 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.79 -1.096 . . . . 4.41 110.157 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -51.94 -32.05 31.44 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.774 0.657 . . . . 5.34 112.774 -174.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -87.66 7.56 29.39 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.696 0.284 . . . . 5.38 111.428 -177.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.11 10.96 85.62 Favored Glycine 0 N--CA 1.452 -0.243 0 C-N-CA 120.944 -0.646 . . . . 4.37 112.011 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -72.08 131.62 43.09 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.342 -0.614 . . . . 4.51 109.342 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -70.01 113.18 6.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.988 0.423 . . . . 4.28 110.171 -179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.625 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 3.7 m -126.88 98.68 4.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.802 0 N-CA-C 108.62 -0.882 . . . . 3.1 108.62 176.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.506 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.6 p -97.17 124.67 48.57 Favored Pre-proline 0 C--N 1.311 -1.08 0 CA-C-N 115.63 -0.714 . . . . 2.5 111.045 -171.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.496 ' O ' HG11 ' A' ' 66' ' ' VAL . 48.4 Cg_exo -59.08 132.52 47.62 Favored 'Trans proline' 0 CA--C 1.513 -0.536 0 C-N-CA 123.0 2.467 . . . . 1.87 112.707 -177.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -96.18 139.23 21.66 Favored Pre-proline 0 N--CA 1.432 -1.361 0 CA-C-N 114.869 -1.059 . . . . 2.74 109.908 175.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.552 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 22.1 Cg_exo -61.72 146.5 96.64 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 121.798 1.665 . . . . 0.84 110.611 176.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -86.01 112.48 21.26 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.339 -0.545 . . . . 1.57 110.243 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.55 ' HG2' HG13 ' A' ' 63' ' ' ILE . 44.7 mtm180 -105.11 112.66 25.88 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-O 121.497 0.665 . . . . 2.52 110.847 -174.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.577 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 58.3 m-70 -96.84 109.92 22.52 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.145 -0.934 . . . . 0.72 109.677 -175.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.578 ' CB ' ' HG2' ' A' ' 61' ' ' ARG . 14.5 ttm -106.43 120.69 42.55 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 119.768 -0.773 . . . . 0.27 110.738 -179.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.434 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.9 m-85 -111.46 130.62 55.66 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.075 -0.966 . . . . 0.27 109.524 178.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.472 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -81.15 153.82 27.06 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 109.358 -0.608 . . . . 1.26 109.358 174.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.418 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 17.3 m-85 -131.27 172.93 11.58 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.436 0.636 . . . . 0.32 111.915 -174.159 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 28.6 p-10 -109.44 -22.48 11.99 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.623 -1.171 . . . . 2.38 110.833 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.452 ' HB2' HG23 ' A' ' 96' ' ' VAL . 48.5 m-80 -144.55 134.88 24.36 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.55 0.691 . . . . 1.1 111.457 -176.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.438 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.2 mmm180 -59.32 -40.32 85.91 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.533 -1.212 . . . . 3.09 112.593 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.464 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 28.8 m -62.21 -34.97 77.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.79 0.329 . . . . 0.35 110.758 -178.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 100' ' ' ILE . 17.3 t -66.17 -57.1 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.415 0 CA-C-N 116.308 -0.406 . . . . 0.23 110.476 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.525 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.4 ptp -58.22 -40.23 81.1 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.034 -0.53 . . . . 0.17 111.016 -177.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 102' ' ' MET . 26.1 t70 -65.7 -41.38 92.43 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.418 -0.513 . . . . 0.34 110.086 178.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 95' ' ' THR . 1.7 t-20 -68.3 -44.3 75.75 Favored 'General case' 0 C--N 1.328 -0.33 0 O-C-N 123.178 0.299 . . . . 1.36 111.336 -179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.663 HG22 HD11 ' A' ' 104' ' ' LEU . 30.6 mm -61.51 -56.95 14.46 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.439 0 N-CA-C 108.684 -0.858 . . . . 0.12 108.684 178.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.788 ' HA ' HD12 ' A' ' 104' ' ' LEU . 30.6 ttpt -50.08 -49.94 49.73 Favored 'General case' 0 C--O 1.217 -0.632 0 O-C-N 124.052 0.845 . . . . 0.79 109.821 176.589 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.576 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 49.9 ttp -49.26 -53.33 22.21 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.406 -0.815 . . . . 0.28 111.289 178.014 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.689 ' O ' HG13 ' A' ' 107' ' ' ILE . 20.7 m -61.03 -54.93 38.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.178 -0.464 . . . . 0.18 110.378 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.914 HD13 HD21 ' A' ' 62' ' ' LEU . 23.6 mt -46.72 -53.73 11.15 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.275 -0.875 . . . . 0.09 110.646 175.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.582 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.9 mt-30 -51.97 -43.08 63.4 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.715 -1.129 . . . . 1.2 112.397 177.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.576 ' HG2' ' O ' ' A' ' 102' ' ' MET . 24.7 mm-40 -70.63 -30.11 66.66 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.736 0.779 . . . . 2.37 109.897 -178.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.689 HG13 ' O ' ' A' ' 103' ' ' THR . 13.1 mt -75.98 -47.3 32.54 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 114.582 -1.19 . . . . 0.15 111.028 -179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.637 HD12 HD11 ' A' ' 48' ' ' LEU . 8.5 mt -58.46 -43.09 86.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.968 -0.56 . . . . 0.19 112.444 -176.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.625 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 16.5 t -67.53 -17.98 64.86 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 111.933 0.346 . . . . 1.14 111.933 -174.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -61.22 -31.95 71.73 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.499 -0.926 . . . . 1.64 108.499 169.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.458 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 15.4 m-85 -105.59 12.99 30.6 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 114.607 -1.179 . . . . 0.65 109.884 179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.625 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 5.2 mmpt? -98.7 -38.6 9.04 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.631 -0.878 . . . . 0.76 108.631 171.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -81.69 -21.98 37.72 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.994 -1.003 . . . . 2.27 110.239 173.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -130.33 69.67 1.45 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.471 -0.786 . . . . 1.2 109.679 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.0 t70 . . . . . 0 C--O 1.246 0.879 0 CA-C-N 115.563 -0.744 . . . . 2.72 111.063 -176.93 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.557 0 N-CA-C 111.874 -0.49 . . . . 19.89 111.874 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 19.8 p -75.67 124.89 88.97 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-O 120.586 0.231 . . . . 18.33 110.836 179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.73 46.02 1.92 Allowed 'Trans proline' 0 CA--C 1.531 0.33 0 C-N-CA 122.971 2.447 . . . . 17.39 112.734 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 74.48 1.32 60.84 Favored Glycine 0 N--CA 1.45 -0.381 0 CA-C-N 116.022 -0.536 . . . . 16.36 113.246 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 60.23 93.73 0.06 OUTLIER Pre-proline 0 N--CA 1.465 0.284 0 CA-C-O 120.972 0.415 . . . . 16.0 110.982 -176.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -56.4 103.75 0.12 Allowed 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 123.228 2.619 . . . . 13.15 113.222 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -75.53 133.02 41.1 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.535 -0.543 . . . . 12.36 109.535 174.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 134.65 -32.46 2.61 Favored Glycine 0 N--CA 1.448 -0.542 0 N-CA-C 110.739 -0.944 . . . . 9.63 110.739 -175.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.402 HD21 ' HB2' ' B' ' 532' ' ' GLU . 5.0 tt -131.21 80.73 1.95 Allowed 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.055 -0.72 . . . . 8.34 109.055 174.57 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 39.3 tp -98.12 1.46 47.58 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 107.466 -1.309 . . . . 10.41 107.466 166.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 8.6 t -174.32 177.56 2.21 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 113.33 -1.759 . . . . 7.62 107.373 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 129.69 -61.94 0.65 Allowed Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.184 -1.007 . . . . 5.19 111.832 179.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -143.54 -33.55 0.43 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.855 0.836 . . . . 5.5 110.141 178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . 0.697 ' HA ' ' OG ' ' B' ' 535' ' ' SER . 7.3 mt-10 -98.22 23.22 8.54 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 114.681 -1.145 . . . . 5.68 110.407 -177.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -56.34 -29.12 60.95 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 114.399 -1.273 . . . . 3.22 111.474 -177.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -114.75 -29.58 6.72 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.49 0.662 . . . . 4.27 110.26 175.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . 0.697 ' OG ' ' HA ' ' B' ' 532' ' ' GLU . 2.4 p -82.46 -3.72 56.23 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.365 -0.834 . . . . 1.25 111.932 -174.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 61.2 p -77.17 -43.37 34.09 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.712 0.768 . . . . 2.08 109.161 171.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 49.5 mm -76.6 -35.31 25.45 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.744 0 CA-C-N 115.064 -0.971 . . . . 1.29 109.58 177.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . 0.5 ' HB3' ' HA ' ' B' ' 535' ' ' SER . . . -78.01 -0.69 28.81 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.483 0.658 . . . . 0.76 110.442 175.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.456 ' HB2' ' O ' ' B' ' 535' ' ' SER . 35.3 t70 -85.22 -42.49 14.63 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.337 -0.986 . . . . 1.23 108.337 171.295 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 64.5 mmm -58.31 -32.13 68.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 114.424 -1.262 . . . . 2.29 109.785 171.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . 0.564 ' OD2' ' HE3' ' A' ' 57' ' ' LYS . 31.8 t70 -60.73 -41.65 95.73 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.926 -1.034 . . . . 1.18 110.812 174.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.409 ' HZ ' ' C ' ' A' ' 50' ' ' ALA . 0.1 OUTLIER -76.67 -31.95 57.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.961 -0.563 . . . . 0.56 111.206 -176.734 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 17.4 m -52.66 -43.1 65.29 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 122.74 0.416 . . . . 1.58 112.065 -174.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -68.22 -32.71 73.11 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.007 0.432 . . . . 0.84 111.029 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.741 ' O ' ' HG2' ' B' ' 548' ' ' GLN . 59.6 mt -78.83 -31.98 45.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.016 -0.538 . . . . 1.08 111.306 -176.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 14.1 mt -77.55 -22.51 50.94 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.4 0.619 . . . . 0.97 109.791 178.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 22.7 t -82.29 -51.8 7.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.928 -1.033 . . . . 1.42 109.986 174.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . 0.741 ' HG2' ' O ' ' B' ' 545' ' ' LEU . 54.5 mm-40 48.97 76.47 0.12 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.299 0.571 . . . . 2.67 111.811 -179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 35.0 pt -90.22 -13.1 9.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.764 -0.653 . . . . 5.23 110.272 179.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 31.2 t 72.98 -54.7 0.69 Allowed 'General case' 0 N--CA 1.465 0.284 0 O-C-N 123.941 0.776 . . . . 6.4 111.556 177.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 42.9 m . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.697 -0.668 . . . . 7.59 110.217 -179.952 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.54 ' HA ' ' OD1' ' A' ' 99' ' ' ASN . 2.1 Cg_endo . . . . . 0 N--CA 1.476 0.455 0 N-CA-C 110.639 -0.562 . . . . 1.89 110.639 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.8 t -136.19 151.23 49.5 Favored 'General case' 0 N--CA 1.444 -0.741 0 CA-C-O 120.972 0.415 . . . . 2.05 110.256 179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.509 ' CD2' HG21 ' A' ' 103' ' ' THR . 27.2 m80 -109.59 6.02 23.55 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.658 -0.701 . . . . 0.75 110.261 178.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.1 t -156.03 155.76 33.22 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 119.981 -0.687 . . . . 1.09 112.411 -172.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.48 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -176.07 -163.84 29.32 Favored Glycine 0 N--CA 1.441 -1.015 0 N-CA-C 110.523 -1.031 . . . . 0.16 110.523 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.9 130.08 46.05 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 117.308 0.554 . . . . 0.16 110.533 -179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.488 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -140.26 143.33 35.89 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.955 0.407 . . . . 0.11 111.548 -178.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.547 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 97.3 mt -106.89 109.24 27.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-N 116.076 -0.511 . . . . 0.33 110.124 176.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -110.19 137.97 47.2 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 108.533 -0.914 . . . . 0.36 108.533 -179.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 53.59 25.84 5.21 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 122.705 0.402 . . . . 0.8 111.154 -176.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt 69.52 5.08 4.98 Favored 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 112.521 0.563 . . . . 2.11 112.521 179.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.432 HG13 ' CH2' ' A' ' 29' ' ' TRP . 2.2 p -94.28 120.53 43.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 107.809 -1.182 . . . . 0.22 107.809 167.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.478 ' HA ' HG12 ' A' ' 8' ' ' ILE . 78.3 p -73.04 142.83 47.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.291 -0.413 . . . . 1.07 110.762 -175.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -163.07 -163.77 16.53 Favored Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.506 -0.854 . . . . 0.11 112.672 -178.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.9 mm -123.41 133.85 67.99 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.917 0 N-CA-C 109.293 -0.632 . . . . 0.13 109.293 -179.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.596 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.84 135.2 41.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 N-CA-C 110.103 -0.332 . . . . 0.13 110.103 -176.257 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.45 129.99 29.81 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.693 0.282 . . . . 0.1 111.254 179.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.445 HD13 ' HB ' ' A' ' 103' ' ' THR . 47.6 mt -85.89 132.86 30.99 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 121.478 0.656 . . . . 0.27 110.439 176.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -102.82 104.92 15.23 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 114.748 -1.115 . . . . 1.24 111.064 -173.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -118.42 170.2 9.12 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.146 -0.687 . . . . 1.2 109.146 176.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.0 t70 79.26 -3.8 2.11 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 122.326 1.06 . . . . 0.58 109.557 -176.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 23' ' ' SER . 30.2 m -102.99 -173.1 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.029 0 CA-C-N 113.832 -1.531 . . . . 0.25 109.427 178.207 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.634 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.1 p -73.56 169.39 18.59 Favored Pre-proline 0 C--N 1.316 -0.858 0 N-CA-C 105.585 -2.006 . . . . 1.13 105.585 175.095 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.422 ' O ' HG13 ' A' ' 41' ' ' VAL . 74.5 Cg_exo -40.83 129.42 2.78 Favored 'Trans proline' 0 C--N 1.358 1.073 0 CA-C-N 121.486 1.566 . . . . 0.16 112.628 -143.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.55 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -54.22 144.03 21.26 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 114.166 -1.379 . . . . 0.1 112.158 -162.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -125.25 168.83 12.94 Favored 'General case' 0 N--CA 1.438 -1.069 0 CA-C-N 114.497 -1.229 . . . . 0.32 111.864 -169.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.819 ' HB3' HG22 ' A' ' 40' ' ' VAL . 2.8 tm? -118.32 106.45 12.78 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 107.592 -1.262 . . . . 0.09 107.592 173.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.1 m -103.31 106.95 17.58 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-O 120.904 0.383 . . . . 0.17 111.027 -175.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.437 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 85.0 t90 -85.16 131.76 34.39 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 108.859 -0.793 . . . . 0.14 108.859 172.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.445 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 65.1 mtt180 -126.24 159.59 32.61 Favored 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 109.287 -0.634 . . . . 1.91 109.287 174.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.8 p -67.51 176.09 2.53 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.013 -0.736 . . . . 0.6 109.013 177.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.9 p -59.59 -41.75 90.98 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 121.659 -0.65 . . . . 0.26 111.013 -179.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -82.82 -31.67 28.01 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.272 -0.64 . . . . 2.12 109.272 171.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.445 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 101.48 17.22 22.45 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-N 115.161 -0.927 . . . . 0.23 113.595 172.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -65.8 -52.04 54.03 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.203 0.501 . . . . 1.73 109.928 174.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 40.8 tttt -77.01 135.93 38.69 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 109.058 -0.719 . . . . 1.3 109.058 176.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 13.8 p -150.03 135.39 10.75 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 CA-C-O 120.91 0.386 . . . . 0.17 111.137 -175.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -141.96 127.0 18.38 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.458 -0.571 . . . . 0.41 109.458 179.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 29.2 m -115.64 131.72 56.85 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.139 0.422 . . . . 0.15 112.139 -172.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.819 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -99.98 129.9 49.94 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 N-CA-C 107.851 -1.166 . . . . 0.12 107.851 168.422 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.442 ' O ' HG12 ' A' ' 45' ' ' ILE . 97.3 t -93.01 121.29 43.59 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 O-C-N 121.148 -0.97 . . . . 0.11 108.577 173.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.482 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -68.52 -17.11 64.09 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.564 0.579 . . . . 0.08 112.564 -170.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.558 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 97.7 p -68.5 -19.49 64.54 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 108.964 -0.754 . . . . 0.87 108.964 174.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.7 p -109.21 15.55 23.12 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 114.897 -1.047 . . . . 0.15 109.994 -177.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.512 HD13 ' HA2' ' A' ' 64' ' ' GLY . 22.2 mm -114.62 141.38 31.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 109.402 -0.592 . . . . 0.12 109.402 177.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -102.01 -47.91 4.41 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.799 -0.637 . . . . 0.52 110.648 -177.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.701 ' O ' HD23 ' A' ' 48' ' ' LEU . 7.8 mtmm -141.86 169.56 17.35 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 120.599 0.238 . . . . 1.41 111.337 -177.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.93 HD22 HD13 ' A' ' 62' ' ' LEU . 0.2 OUTLIER -141.26 154.34 45.7 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.72 -0.845 . . . . 0.73 108.72 175.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.624 ' HG3' HD11 ' A' ' 63' ' ' ILE . 23.5 mt-30 -135.74 145.55 46.74 Favored 'General case' 0 C--O 1.213 -0.855 0 N-CA-C 109.365 -0.606 . . . . 1.94 109.365 -179.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.475 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -137.92 134.74 35.34 Favored 'General case' 0 C--N 1.319 -0.746 0 O-C-N 121.726 -0.609 . . . . 0.22 110.672 175.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.454 HG21 ' HB3' ' A' ' 57' ' ' LYS . 68.8 p -59.99 119.08 38.4 Favored Pre-proline 0 C--N 1.331 -0.213 0 CA-C-N 115.801 -0.636 . . . . 0.26 110.704 -177.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.485 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 17.4 Cg_exo -57.21 162.19 9.97 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.664 2.242 . . . . 0.38 111.948 177.032 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -68.8 -19.6 64.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.084 -0.507 . . . . 0.66 110.899 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 45.7 t -82.59 -18.15 42.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.921 -0.581 . . . . 1.5 110.594 176.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.485 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 48.1 m -76.09 137.8 40.37 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 116.261 -0.427 . . . . 0.85 111.057 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.577 ' HB2' ' HD2' ' A' ' 57' ' ' LYS . 39.8 mt-10 -52.38 -35.38 51.42 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 122.038 0.923 . . . . 1.77 109.987 173.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.577 ' HD2' ' HB2' ' A' ' 56' ' ' GLU . 10.6 mptt -82.09 158.06 23.86 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.112 -1.404 . . . . 1.63 112.984 -169.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.403 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.3 OUTLIER -130.68 96.65 4.15 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 114.585 -1.189 . . . . 1.11 108.485 169.295 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.464 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.2 OUTLIER -155.16 154.43 32.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.237 0.541 . . . . 0.22 111.55 -173.799 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -131.0 120.68 23.84 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.452 -0.944 . . . . 0.1 108.452 177.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.586 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 14.1 mtp180 -104.6 145.11 30.78 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.036 0.446 . . . . 2.99 111.743 -177.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.939 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -122.43 106.69 11.27 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.31 -0.859 . . . . 0.13 109.587 -179.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.624 HD11 ' HG3' ' A' ' 49' ' ' GLN . 1.9 mp -85.19 99.39 7.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 C-N-CA 122.484 0.314 . . . . 0.29 110.211 -174.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.512 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -72.57 145.13 36.65 Favored Glycine 0 C--O 1.221 -0.689 0 C-N-CA 120.971 -0.633 . . . . 0.54 112.587 -179.088 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.414 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 89.2 mttt -66.2 146.29 54.8 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 122.692 0.397 . . . . 0.55 111.16 179.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.801 HG13 ' HA ' ' A' ' 84' ' ' PRO . 6.5 m -120.1 150.99 22.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 C-N-CA 120.308 -0.557 . . . . 1.73 111.332 169.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.71 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 26.3 t70 -83.16 83.63 7.78 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 108.469 -0.937 . . . . 3.23 108.469 172.072 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -64.84 -4.68 4.69 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.702 0.63 . . . . 2.39 112.702 -169.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.6 p -77.49 -4.04 43.52 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.08 0.467 . . . . 2.96 110.524 172.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.71 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.7 ptpt -85.2 30.39 0.6 Allowed 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.907 -0.588 . . . . 2.49 110.669 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.451 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 20.0 mtmt -46.82 114.81 0.9 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.262 0.553 . . . . 3.4 110.269 -174.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 55.6 ttt180 -89.11 168.62 12.18 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 108.611 -0.885 . . . . 3.8 108.611 -169.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.633 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 58.1 mttp -131.13 140.08 49.92 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 118.298 0.499 . . . . 4.29 110.625 174.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.402 ' CG ' ' H ' ' A' ' 75' ' ' ASN . 9.1 t70 -83.61 -173.07 4.5 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.763 -0.653 . . . . 4.41 110.323 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.402 ' H ' ' CG ' ' A' ' 74' ' ' ASP . 29.7 m-80 -59.56 -31.63 69.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.212 0.53 . . . . 5.34 110.853 -177.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -87.35 1.43 53.34 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.969 -0.56 . . . . 5.38 110.789 -177.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 84.26 7.74 84.59 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.753 -0.737 . . . . 4.37 111.681 -175.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.633 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 51.1 m-20 -57.4 128.32 36.45 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 110.186 -0.301 . . . . 4.51 110.186 -179.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -73.59 90.12 1.76 Allowed 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.676 -0.491 . . . . 4.28 109.676 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.439 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 11.1 m -103.24 98.47 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.954 0 CA-C-O 122.026 0.917 . . . . 3.1 109.618 -178.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.489 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.2 p -88.1 119.78 70.47 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-N 115.57 -0.741 . . . . 2.5 109.736 -178.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 31.4 Cg_exo -63.16 134.52 46.13 Favored 'Trans proline' 0 CA--C 1.51 -0.712 0 C-N-CA 122.881 2.387 . . . . 1.87 112.588 -173.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.485 ' HE3' ' O ' ' B' ' 523' ' ' TYR . 12.7 ptmm? -79.96 159.87 70.01 Favored Pre-proline 0 C--N 1.315 -0.917 0 CA-C-N 115.117 -0.947 . . . . 2.74 108.558 174.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.801 ' HA ' HG13 ' A' ' 66' ' ' VAL . 32.0 Cg_exo -57.24 152.75 43.73 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.327 2.018 . . . . 0.84 111.851 -177.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -64.59 164.21 12.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.494 -0.775 . . . . 1.57 109.516 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.559 ' HG2' ' CZ ' ' A' ' 61' ' ' ARG . 44.0 ttt180 -155.74 110.51 2.92 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 122.289 1.043 . . . . 2.52 109.973 -178.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.593 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 78.0 m-70 -95.71 152.2 18.67 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 113.738 -1.574 . . . . 0.72 107.695 -176.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.586 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 26.3 ttm -141.87 129.52 21.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 119.183 0.901 . . . . 0.27 111.77 174.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.488 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 4.7 m-85 -118.4 129.38 55.38 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.361 -0.836 . . . . 0.27 109.527 178.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.547 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.03 153.13 27.57 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 121.996 -0.44 . . . . 1.26 110.526 177.217 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.428 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.0 m-85 -133.59 172.53 12.62 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.027 0.441 . . . . 0.32 111.133 -175.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -119.26 -11.58 9.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.567 -0.742 . . . . 2.38 109.804 177.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.513 ' HB2' HG23 ' A' ' 96' ' ' VAL . 41.5 m-80 -142.66 131.01 22.2 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.212 0.53 . . . . 1.1 110.633 -177.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.498 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.5 mmm180 -64.62 -34.2 77.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.196 -0.911 . . . . 3.09 111.938 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 26.2 m -62.75 -36.23 82.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.883 0.373 . . . . 0.35 110.824 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.566 ' O ' HG12 ' A' ' 100' ' ' ILE . 10.5 t -67.71 -56.11 14.41 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.399 0 CA-C-N 116.074 -0.512 . . . . 0.23 110.306 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.581 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.8 ptp -58.45 -37.83 76.27 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.088 -0.505 . . . . 0.17 111.041 -177.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -70.09 -26.25 63.89 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.973 -0.291 . . . . 0.34 111.085 -179.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.54 ' OD1' ' HA ' ' A' ' 1' ' ' PRO . 5.5 m-80 -85.93 -39.65 16.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.312 -0.403 . . . . 1.36 111.034 178.425 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.66 HG22 HD11 ' A' ' 104' ' ' LEU . 29.0 mm -64.98 -56.44 15.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 108.729 -0.841 . . . . 0.12 108.729 176.362 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.686 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.0 ttpt -48.31 -47.75 36.41 Favored 'General case' 0 CA--C 1.513 -0.445 0 O-C-N 123.894 0.746 . . . . 0.79 110.161 175.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.724 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 36.2 ttp -50.89 -60.44 3.07 Favored 'General case' 0 CA--C 1.513 -0.466 0 CA-C-N 115.186 -0.915 . . . . 0.28 111.084 178.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.757 ' O ' HG13 ' A' ' 107' ' ' ILE . 86.6 m -55.95 -53.84 52.03 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 123.49 0.494 . . . . 0.18 110.75 -178.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.939 HD13 HD21 ' A' ' 62' ' ' LEU . 25.8 mt -46.54 -58.03 4.17 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 123.694 0.621 . . . . 0.09 110.261 176.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.529 ' HG3' HD12 ' A' ' 48' ' ' LEU . 70.4 mt-30 -52.69 -44.56 66.36 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 115.303 -0.862 . . . . 1.2 112.511 175.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.724 ' HG3' ' O ' ' A' ' 102' ' ' MET . 48.3 mt-30 -62.07 -30.65 71.13 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.709 0.766 . . . . 2.37 109.659 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.757 HG13 ' O ' ' A' ' 103' ' ' THR . 6.4 mt -81.75 -41.1 18.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 114.688 -1.142 . . . . 0.15 111.297 -177.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.778 HD11 HD21 ' A' ' 48' ' ' LEU . 5.2 mt -60.27 -42.2 89.68 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 N-CA-C 112.948 0.721 . . . . 0.19 112.948 -174.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.648 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 2.1 p -65.81 -16.35 63.72 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.573 -0.451 . . . . 1.14 112.159 -175.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -63.06 -28.27 69.97 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.637 0.732 . . . . 1.64 109.096 169.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.558 ' CG ' ' HA ' ' A' ' 43' ' ' SER . 29.0 m-85 -110.41 10.83 23.32 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 114.95 -1.023 . . . . 0.65 110.309 -179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.648 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 9.2 mmpt? -94.44 -38.25 11.03 Favored 'General case' 0 CA--C 1.511 -0.535 0 N-CA-C 108.648 -0.871 . . . . 0.76 108.648 171.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -85.95 -24.65 26.46 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.848 -1.069 . . . . 2.27 110.619 176.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -124.89 66.2 1.11 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.131 -0.486 . . . . 1.2 111.171 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.459 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 35.7 t70 . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.557 -0.735 . . . . 2.72 110.108 178.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.728 0 N-CA-C 111.783 -0.527 . . . . 19.89 111.783 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 20.7 m 60.44 70.7 0.95 Allowed Pre-proline 0 CA--C 1.53 0.208 0 CA-C-O 121.008 0.432 . . . . 18.33 111.059 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo -80.66 33.56 0.52 Allowed 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.977 2.452 . . . . 17.39 112.97 -177.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -69.18 -44.68 65.08 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 111.336 -0.706 . . . . 16.36 111.336 176.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . 0.485 ' O ' ' HE3' ' A' ' 83' ' ' LYS . 76.4 m-85 -121.56 91.04 48.35 Favored Pre-proline 0 C--N 1.323 -0.568 0 N-CA-C 109.298 -0.63 . . . . 16.0 109.298 174.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 14.5 Cg_exo -71.31 -60.45 0.06 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.494 2.129 . . . . 13.15 112.119 178.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -168.89 178.0 4.74 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.778 -0.823 . . . . 12.36 108.778 -178.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -177.62 -129.33 1.25 Allowed Glycine 0 N--CA 1.448 -0.503 0 N-CA-C 111.41 -0.676 . . . . 9.63 111.41 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.589 HD13 ' H ' ' B' ' 527' ' ' LEU . 0.0 OUTLIER -79.94 46.23 0.78 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.359 0.6 . . . . 8.34 110.99 177.818 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . 0.479 HD21 ' H ' ' A' ' 86' ' ' ARG . 7.1 tt -81.03 86.36 6.14 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.737 -0.665 . . . . 10.41 110.411 -173.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 23.9 m 59.36 16.49 5.12 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 115.37 -0.832 . . . . 7.62 112.822 172.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 71.07 40.08 62.38 Favored Glycine 0 N--CA 1.448 -0.523 0 C-N-CA 120.884 -0.674 . . . . 5.19 112.416 -177.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -113.94 49.11 1.02 Allowed 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.85 -1.167 . . . . 5.5 107.85 177.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -99.84 -6.93 26.02 Favored 'General case' 0 N--CA 1.436 -1.15 0 CA-C-N 114.272 -1.331 . . . . 5.68 113.185 -164.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -97.68 -62.16 1.29 Allowed 'General case' 0 C--N 1.302 -1.461 0 N-CA-C 113.026 0.75 . . . . 3.22 113.026 -170.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 21.6 p90 -115.11 -35.01 4.84 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.373 0.606 . . . . 4.27 110.87 -178.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . 0.428 ' HA ' ' HB3' ' B' ' 538' ' ' ALA . 1.4 p -76.62 -3.35 37.28 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.412 -0.813 . . . . 1.25 110.132 178.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . 0.53 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 22.7 p -74.64 -43.95 52.88 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.579 -0.737 . . . . 2.08 109.735 171.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 35.9 mm -75.09 -37.22 40.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.536 -0.756 . . . . 1.29 109.953 176.477 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . 0.428 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -76.47 1.57 16.15 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.854 0.835 . . . . 0.76 110.591 177.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.53 ' HB3' ' O ' ' B' ' 536' ' ' SER . 6.6 t70 -88.07 -53.08 4.9 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.687 -1.142 . . . . 1.23 109.079 173.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 42.3 ttp -55.97 -36.71 68.14 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.767 -1.106 . . . . 2.29 109.621 173.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . 0.538 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 2.0 t70 -55.17 -50.87 68.24 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.385 -1.28 . . . . 1.18 111.018 177.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.581 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.3 OUTLIER -64.12 -37.43 87.42 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.095 0.474 . . . . 0.56 111.013 -173.511 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 12.6 m -64.36 -21.72 66.72 Favored 'General case' 0 N--CA 1.435 -1.209 0 CA-C-N 115.885 -0.598 . . . . 1.58 110.957 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -91.82 -23.51 19.66 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.027 -0.533 . . . . 0.84 110.78 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 96.5 mt -75.86 -29.87 58.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.31 -0.404 . . . . 1.08 111.648 -178.214 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . 0.515 HD11 ' HB3' ' A' ' 49' ' ' GLN . 56.7 mt -89.02 -5.91 57.57 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.712 0.768 . . . . 0.97 109.009 173.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 28.7 t -115.78 41.26 2.58 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.448 -1.251 . . . . 1.42 110.311 178.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 -85.23 21.98 1.58 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.824 0.345 . . . . 2.67 110.211 178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . 0.403 ' O ' HG22 ' B' ' 549' ' ' ILE . 13.6 mt 62.61 21.98 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-O 121.821 0.82 . . . . 5.23 110.074 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 23.5 m -137.88 43.09 2.26 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.692 -0.685 . . . . 6.4 110.631 -175.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 49.6 m . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.675 -0.678 . . . . 7.59 109.935 178.045 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.533 ' HA ' ' OD1' ' A' ' 99' ' ' ASN . 3.0 Cg_exo . . . . . 0 N--CA 1.478 0.57 0 N-CA-C 110.45 -0.635 . . . . 1.89 110.45 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 p -86.9 143.19 27.53 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-O 121.215 0.531 . . . . 2.05 110.809 -177.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.442 ' CD2' HG21 ' A' ' 103' ' ' THR . 50.8 m80 -99.44 8.05 44.91 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.693 -0.685 . . . . 0.75 110.341 179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 43.3 t -157.05 157.6 34.91 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.544 0.687 . . . . 1.09 112.409 -172.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.528 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 179.39 -167.16 37.0 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 109.813 -1.315 . . . . 0.16 109.813 179.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -93.73 135.62 34.84 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 118.008 0.904 . . . . 0.16 110.583 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.502 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -146.78 142.14 27.44 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.074 -0.512 . . . . 0.11 111.376 -177.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.789 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.0 mt -98.95 128.25 50.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 110.193 -0.299 . . . . 0.33 110.193 174.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.482 ' HE2' ' ND1' ' A' ' 38' ' ' HIS . 10.7 t80 -135.19 140.48 45.36 Favored 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.756 -0.831 . . . . 0.36 108.756 175.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 60.63 24.27 14.04 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 123.451 0.469 . . . . 0.8 109.87 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt 69.49 -2.75 1.81 Allowed 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 124.018 0.927 . . . . 2.11 113.109 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -92.31 123.68 44.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 N-CA-C 108.766 -0.828 . . . . 0.22 108.766 170.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 18.3 m -74.86 145.38 42.81 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.325 -0.398 . . . . 1.07 110.362 -176.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -164.01 -158.53 10.15 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 119.869 -1.158 . . . . 0.11 113.497 -176.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.4 mm -125.3 131.5 72.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 109.456 -0.572 . . . . 0.13 109.456 -177.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.544 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -101.55 136.15 34.8 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 N-CA-C 110.005 -0.369 . . . . 0.13 110.005 -177.297 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.49 131.31 31.64 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.608 0.242 . . . . 0.1 111.39 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.41 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 54.7 mt -86.21 138.41 19.11 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 121.211 0.529 . . . . 0.27 110.403 176.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 33.8 t30 -109.83 105.23 14.36 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.928 -1.033 . . . . 1.24 111.246 -175.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.437 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 36.5 mt-10 -116.99 170.35 8.7 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.902 -0.777 . . . . 1.2 108.902 175.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.437 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 36.3 t70 78.58 -5.01 2.09 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.38 1.086 . . . . 0.58 109.777 -177.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.649 HG23 ' O ' ' A' ' 23' ' ' SER . 31.1 m -102.62 -173.33 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.154 0 CA-C-N 113.872 -1.513 . . . . 0.25 109.824 -179.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.649 ' O ' HG23 ' A' ' 22' ' ' VAL . 48.2 m -72.78 167.33 34.56 Favored Pre-proline 0 C--N 1.315 -0.914 0 N-CA-C 105.322 -2.103 . . . . 1.13 105.322 174.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -41.49 127.62 3.28 Favored 'Trans proline' 0 C--N 1.352 0.736 0 CA-C-N 121.13 1.439 . . . . 0.16 112.534 -142.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.474 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -49.64 140.25 11.41 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 113.919 -1.491 . . . . 0.1 112.434 -165.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -125.43 169.48 12.34 Favored 'General case' 0 N--CA 1.438 -1.074 0 CA-C-N 114.09 -1.414 . . . . 0.32 111.585 -168.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.794 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -118.89 105.64 11.7 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 107.612 -1.255 . . . . 0.09 107.612 173.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 m -100.67 106.48 17.94 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-O 120.973 0.416 . . . . 0.17 110.743 -176.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.3 t90 -85.01 132.02 34.39 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 108.91 -0.774 . . . . 0.14 108.91 171.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.503 ' HG2' HG23 ' A' ' 37' ' ' VAL . 93.6 mtt180 -126.0 159.74 31.89 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 109.258 -0.645 . . . . 1.91 109.258 174.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.8 p -70.71 177.68 3.44 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 110.077 -0.342 . . . . 0.6 110.077 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 p -64.79 -23.19 67.16 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.398 -0.521 . . . . 0.26 111.479 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -99.4 -31.63 11.56 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.644 0.735 . . . . 2.12 109.054 169.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.466 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 98.49 16.59 31.39 Favored Glycine 0 N--CA 1.445 -0.737 0 CA-C-N 114.712 -1.131 . . . . 0.23 112.153 178.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -67.19 -39.63 86.4 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 109.263 -0.643 . . . . 1.73 109.263 175.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.8 tttm -93.68 141.21 28.74 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.412 -0.959 . . . . 1.3 108.412 175.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.503 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.1 p -147.31 136.89 16.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 120.963 0.411 . . . . 0.17 111.007 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.482 ' ND1' ' HE2' ' A' ' 9' ' ' PHE . 3.3 t60 -143.67 118.07 9.67 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.275 -0.421 . . . . 0.41 109.941 -178.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 24.7 m -110.79 133.79 53.05 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.409 0.522 . . . . 0.15 112.409 -173.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.794 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.63 130.24 54.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 N-CA-C 108.103 -1.073 . . . . 0.12 108.103 168.543 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 90.4 t -93.34 120.4 42.67 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 O-C-N 121.202 -0.936 . . . . 0.11 108.754 173.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.553 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -68.14 -19.4 64.81 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 113.231 0.826 . . . . 0.08 113.231 -169.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.564 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 9.8 p -70.2 -13.45 62.19 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.336 0.589 . . . . 0.87 109.641 175.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.4 p -108.66 11.28 26.63 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-N 115.477 -0.783 . . . . 0.15 109.583 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.531 HG21 ' CD1' ' A' ' 62' ' ' LEU . 26.3 mm -113.83 144.68 20.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 109.102 -0.703 . . . . 0.12 109.102 178.593 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 39.1 t70 -110.77 -41.79 4.19 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.78 0.324 . . . . 0.52 110.968 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.528 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 14.9 mtmt -140.33 174.39 10.56 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-O 121.106 0.479 . . . . 1.41 111.029 -179.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.595 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -152.49 134.73 15.04 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.673 -0.862 . . . . 0.73 108.673 -178.106 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -133.45 115.19 14.5 Favored 'General case' 0 N--CA 1.469 0.508 0 O-C-N 122.268 -0.27 . . . . 1.94 111.289 -170.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.457 ' HB2' ' HG ' ' A' ' 60' ' ' LEU . . . -114.8 146.67 40.77 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 122.179 -0.326 . . . . 0.22 111.802 -175.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.492 ' N ' ' HZ ' ' B' ' 542' ' ' PHE . 80.5 p -72.44 120.91 83.15 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 115.922 -0.581 . . . . 0.26 110.921 -176.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.604 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 10.0 Cg_exo -62.3 165.96 13.98 Favored 'Trans proline' 0 N--CA 1.462 -0.361 0 C-N-CA 122.832 2.355 . . . . 0.38 111.921 175.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.89 -27.25 67.35 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.042 -0.526 . . . . 0.66 111.313 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.5 m -84.91 -4.84 59.28 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.87 -0.605 . . . . 1.5 110.772 -179.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.604 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 35.2 m -82.64 148.53 27.91 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.03 -0.532 . . . . 0.85 111.635 178.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -70.52 7.04 1.17 Allowed 'General case' 0 CA--C 1.51 -0.567 0 CA-C-N 115.169 -0.923 . . . . 1.77 111.909 179.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.475 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 40.7 mmtm -130.26 153.3 48.76 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 115.171 -0.922 . . . . 1.63 111.204 -167.265 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.462 ' O ' ' HG3' ' A' ' 59' ' ' MET . 80.1 mmm -125.61 97.23 5.08 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 108.565 -0.902 . . . . 1.11 108.565 167.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.475 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.28 156.32 35.33 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.242 0.544 . . . . 0.22 111.983 -172.538 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.54 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.3 tt -135.17 118.88 17.11 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.435 -0.95 . . . . 0.1 108.435 177.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.736 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 2.2 mtp180 -101.85 144.6 30.3 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.342 0.591 . . . . 2.99 111.748 -178.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.899 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -120.24 110.19 16.29 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 114.776 -1.102 . . . . 0.13 108.863 178.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.511 HG13 ' HG2' ' A' ' 86' ' ' ARG . 2.4 mp -88.88 100.91 11.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.135 0.493 . . . . 0.29 110.475 -172.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.639 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -71.22 141.02 31.91 Favored Glycine 0 N--CA 1.449 -0.435 0 CA-C-N 115.652 -0.704 . . . . 0.54 112.615 -177.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.461 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 79.7 mttt -60.98 123.76 18.54 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 112.992 0.738 . . . . 0.55 112.992 -174.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.72 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 2.0 t -120.3 139.76 46.54 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 114.933 -1.03 . . . . 1.73 109.744 171.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.505 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 5.3 m-20 -80.13 86.9 5.51 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 108.687 -0.856 . . . . 3.23 108.687 174.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 71' ' ' LYS . 43.1 mt-10 -65.02 -2.58 2.8 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.606 0.241 . . . . 2.39 111.618 -175.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.422 ' C ' ' H ' ' A' ' 71' ' ' LYS . 12.9 p -69.6 -13.26 62.23 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.388 0.613 . . . . 2.96 109.761 169.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.543 ' NZ ' ' HG2' ' A' ' 82' ' ' PRO . 13.6 ptmm? -75.34 29.69 0.1 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.164 -0.926 . . . . 2.49 110.797 177.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 68' ' ' GLU . 20.0 mtmt -48.09 114.66 0.97 Allowed 'General case' 0 CA--C 1.515 -0.38 0 CA-C-O 121.369 0.604 . . . . 3.4 109.835 -174.492 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.528 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 79.3 ttt180 -92.91 165.65 12.78 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 114.976 -1.011 . . . . 3.8 108.838 -171.333 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.42 ' HD3' ' O ' ' A' ' 77' ' ' GLY . 54.9 mttp -127.11 139.34 53.05 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.302 0.572 . . . . 4.29 109.919 171.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.432 ' CG ' ' H ' ' A' ' 75' ' ' ASN . 13.7 t70 -91.79 -165.33 1.33 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.175 -0.92 . . . . 4.41 110.368 -174.471 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.432 ' H ' ' CG ' ' A' ' 74' ' ' ASP . 78.9 m-20 -62.71 -33.17 74.56 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.375 0.509 . . . . 5.34 112.375 -169.11 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -84.28 1.62 43.97 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 111.67 0.248 . . . . 5.38 111.67 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.42 ' O ' ' HD3' ' A' ' 73' ' ' LYS . . . 79.72 4.33 89.34 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.55 -0.833 . . . . 4.37 111.422 -175.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -72.01 140.49 49.09 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.921 -0.4 . . . . 4.51 109.921 178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -68.98 116.87 9.94 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.105 -0.498 . . . . 4.28 110.879 -176.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.528 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 9.8 m -122.47 98.85 6.13 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 108.877 -0.786 . . . . 3.1 108.877 173.021 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 1.2 p -86.31 109.94 27.34 Favored Pre-proline 0 C--N 1.316 -0.867 0 CA-C-O 121.235 0.541 . . . . 2.5 110.126 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.543 ' HG2' ' NZ ' ' A' ' 70' ' ' LYS . 52.5 Cg_exo -60.91 138.89 81.9 Favored 'Trans proline' 0 CA--C 1.513 -0.547 0 C-N-CA 123.549 2.833 . . . . 1.87 112.279 -177.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 7.0 ptmm? -94.27 155.26 40.06 Favored Pre-proline 0 N--CA 1.442 -0.841 0 CA-C-N 115.167 -0.924 . . . . 2.74 110.251 -175.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.72 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 72.8 Cg_exo -48.06 153.32 2.82 Favored 'Trans proline' 0 N--CA 1.461 -0.384 0 C-N-CA 123.576 2.851 . . . . 0.84 113.461 177.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.414 ' NE2' HD13 ' B' ' 528' ' ' LEU . 96.3 mt-30 -86.9 115.4 24.28 Favored 'General case' 0 CA--C 1.501 -0.933 0 CA-C-N 115.21 -0.904 . . . . 1.57 109.679 -176.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.511 ' HG2' HG13 ' A' ' 63' ' ' ILE . 85.9 mtt180 -100.44 130.37 46.52 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-N 114.97 -1.014 . . . . 2.52 111.307 -171.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.515 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 67.1 m-70 -95.87 145.88 25.02 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 106.954 -1.499 . . . . 0.72 106.954 176.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.736 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 15.6 ttm -140.09 125.98 19.54 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 119.403 1.001 . . . . 0.27 111.814 175.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.473 ' O ' ' HA ' ' A' ' 59' ' ' MET . 15.8 m-85 -108.12 158.07 17.74 Favored 'General case' 0 N--CA 1.439 -1.017 0 CA-C-N 114.965 -1.016 . . . . 0.27 108.72 176.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.789 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -106.69 157.6 17.59 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 108.806 -0.812 . . . . 1.26 108.806 175.455 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.54 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 30.9 m-85 -139.39 170.46 15.88 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-O 121.011 0.434 . . . . 0.32 111.615 -176.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -123.86 -5.78 7.98 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.593 -0.731 . . . . 2.38 110.379 176.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.43 ' HB2' HG23 ' A' ' 96' ' ' VAL . 50.6 m-80 -147.13 126.15 12.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.041 -0.527 . . . . 1.1 109.918 179.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.631 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 13.8 mmm180 -61.52 -35.4 77.62 Favored 'General case' 0 CA--C 1.51 -0.595 0 CA-C-N 116.011 -0.541 . . . . 3.09 110.994 177.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.8 m -56.85 -36.2 69.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.186 -0.461 . . . . 0.35 110.423 -176.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.633 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.6 t -69.18 -60.26 2.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 CA-C-N 116.022 -0.536 . . . . 0.23 110.329 176.495 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.631 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.5 ptp -57.93 -40.14 79.71 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-N 116.578 -0.283 . . . . 0.17 110.813 -176.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.487 ' N ' ' HG3' ' A' ' 97' ' ' MET . 35.2 t70 -58.92 -44.44 91.31 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.477 -0.489 . . . . 0.34 110.381 176.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.533 ' OD1' ' HA ' ' A' ' 1' ' ' PRO . 5.9 m-80 -72.24 -42.4 65.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.303 -0.408 . . . . 1.36 111.927 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.633 HG12 ' O ' ' A' ' 96' ' ' VAL . 27.3 mm -61.94 -56.94 14.49 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.417 0 N-CA-C 108.833 -0.802 . . . . 0.12 108.833 178.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.737 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.7 ttpt -49.43 -52.69 27.22 Favored 'General case' 0 C--O 1.216 -0.683 0 O-C-N 123.934 0.771 . . . . 0.79 109.762 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.557 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 39.1 ttp -48.17 -53.28 17.36 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.121 -0.945 . . . . 0.28 111.474 178.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.732 ' O ' HG13 ' A' ' 107' ' ' ILE . 85.6 m -60.64 -54.51 44.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.134 -0.484 . . . . 0.18 110.483 178.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.899 HD13 HD21 ' A' ' 62' ' ' LEU . 24.9 mt -47.9 -54.54 12.33 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.782 0.676 . . . . 0.09 110.63 177.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.567 ' HG2' HD13 ' A' ' 48' ' ' LEU . 94.1 mt-30 -49.02 -49.0 43.25 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.391 -1.277 . . . . 1.2 111.923 176.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.557 ' HG2' ' O ' ' A' ' 102' ' ' MET . 27.6 mm-40 -67.77 -28.38 67.56 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.451 0.643 . . . . 2.37 110.556 -177.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.732 HG13 ' O ' ' A' ' 103' ' ' THR . 8.2 mt -75.87 -41.18 39.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 CA-C-N 115.128 -0.942 . . . . 0.15 110.642 179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.534 HD12 HD11 ' A' ' 48' ' ' LEU . 7.5 mt -65.16 -40.58 89.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 116.387 -0.369 . . . . 0.19 111.614 -178.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 6.2 p -61.02 -18.91 60.34 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.838 0.351 . . . . 1.14 111.517 -177.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 91.8 mtt180 -66.58 -48.71 68.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.311 0.577 . . . . 1.64 109.443 173.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.564 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 15.4 m-85 -77.48 -22.68 50.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.316 -0.857 . . . . 0.65 109.859 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.93 -21.43 65.11 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.019 -0.991 . . . . 0.76 109.911 177.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -99.59 -37.71 9.04 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.823 -0.626 . . . . 2.27 110.042 175.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -87.0 29.84 0.8 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.3 -0.864 . . . . 1.2 112.223 -172.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 30.4 t70 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.611 -0.709 . . . . 2.72 109.929 177.108 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.759 0 N-CA-C 112.0 -0.44 . . . . 19.89 112.0 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 22.2 t -129.47 80.02 72.79 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-O 120.995 0.426 . . . . 18.33 110.867 179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -87.32 176.26 4.34 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 122.806 2.337 . . . . 17.39 111.47 175.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -86.22 0.3 87.24 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.893 -0.67 . . . . 16.36 111.719 177.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 57.61 72.77 0.85 Allowed Pre-proline 0 C--N 1.331 -0.219 0 C-N-CA 123.265 0.626 . . . . 16.0 111.53 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.83 -39.13 11.97 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.312 2.008 . . . . 13.15 111.398 175.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -105.57 -45.81 4.33 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.936 -0.575 . . . . 12.36 109.858 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 144.01 -144.47 13.54 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.765 -0.731 . . . . 9.63 112.466 178.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 7.9 tt -134.45 96.72 3.64 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.634 -0.506 . . . . 8.34 109.634 -179.32 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . 0.414 HD13 ' NE2' ' A' ' 85' ' ' GLN . 45.8 tp -113.49 9.59 18.07 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.882 -0.784 . . . . 10.41 108.882 174.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 7.9 p -166.23 56.56 0.1 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.195 -0.911 . . . . 7.62 110.658 -176.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -124.51 -97.26 1.18 Allowed Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.61 -0.805 . . . . 5.19 112.076 -177.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -127.36 14.43 7.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.035 0.445 . . . . 5.5 110.426 -178.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . 0.512 ' HA ' ' OG ' ' B' ' 535' ' ' SER . 4.8 mm-40 -105.66 15.85 26.26 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.748 0.785 . . . . 5.68 111.158 -177.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -76.92 -57.94 3.56 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.768 -1.106 . . . . 3.22 111.061 -178.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 47.3 p90 -66.77 -24.61 66.22 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.417 0.627 . . . . 4.27 110.685 -179.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . 0.574 ' HA ' ' HB3' ' B' ' 538' ' ' ALA . 3.9 p -81.48 -4.05 54.78 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.561 -0.745 . . . . 1.25 110.619 179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . 0.408 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 22.9 t -77.64 -25.54 49.75 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.031 -0.729 . . . . 2.08 109.031 171.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 40.9 mm -84.83 -31.22 7.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 N-CA-C 109.282 -0.636 . . . . 1.29 109.282 171.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . 0.574 ' HB3' ' HA ' ' B' ' 535' ' ' SER . . . -75.95 2.49 12.47 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.778 0.799 . . . . 0.76 110.103 172.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' B' ' 536' ' ' SER . 23.7 t0 -82.35 -41.55 19.88 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.923 -1.035 . . . . 1.23 108.333 170.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 81.4 mmm -60.26 -33.82 72.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.434 -1.257 . . . . 2.29 109.624 172.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -57.23 -57.16 13.8 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.436 -0.802 . . . . 1.18 109.966 174.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.492 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -60.42 -40.95 92.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.116 -0.947 . . . . 0.56 111.558 -176.048 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 36.6 m -61.27 -37.27 82.52 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.903 -0.59 . . . . 1.58 111.441 -178.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . 0.411 ' O ' ' HG2' ' B' ' 548' ' ' GLN . . . -78.88 -28.15 44.08 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.215 0.531 . . . . 0.84 110.215 176.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.427 HD21 ' HB3' ' A' ' 55' ' ' SER . 58.4 tp -71.57 -49.59 39.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.138 -0.937 . . . . 1.08 111.643 -177.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 8.5 mt -70.06 -25.51 63.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.365 0.602 . . . . 0.97 109.791 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 18.3 t -70.73 -15.28 62.68 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.073 -0.967 . . . . 1.42 110.503 177.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' B' ' 544' ' ' ALA . 16.2 mm100 -68.13 -37.08 80.69 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-O 121.517 0.675 . . . . 2.67 110.537 177.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 51.3 mt -92.51 -43.02 13.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.951 0 CA-C-N 114.798 -1.092 . . . . 5.23 110.193 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 22.2 t -82.19 82.52 7.69 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.783 -0.644 . . . . 6.4 110.303 -179.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.339 -0.839 . . . . 7.59 110.081 176.684 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo . . . . . 0 N--CA 1.474 0.366 0 N-CA-C 110.645 -0.56 . . . . 1.89 110.645 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.2 m -72.81 116.83 13.78 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-O 121.418 0.627 . . . . 2.05 110.716 -176.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.515 ' HA ' HD12 ' A' ' 18' ' ' ILE . 41.7 m80 -92.21 11.57 25.22 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.387 -0.824 . . . . 0.75 109.704 176.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.8 p -158.29 164.68 36.18 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 119.749 -0.78 . . . . 1.09 112.648 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.444 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 176.76 -163.75 32.91 Favored Glycine 0 N--CA 1.439 -1.136 0 CA-C-N 114.692 -1.14 . . . . 0.16 110.916 -179.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.83 135.72 43.97 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.677 -0.49 . . . . 0.16 109.677 178.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.508 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -148.54 143.01 26.36 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.039 0.447 . . . . 0.11 111.756 -175.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.489 HG12 ' HA ' ' A' ' 13' ' ' SER . 89.1 mt -106.63 124.21 62.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.22 -0.446 . . . . 0.33 110.226 177.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.3 t80 -127.35 140.75 51.98 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 108.682 -0.858 . . . . 0.36 108.682 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 54.36 25.62 6.16 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 122.636 0.375 . . . . 0.8 111.113 -178.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 36.5 mtmm 65.49 14.44 9.47 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.801 0.667 . . . . 2.11 112.801 -177.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.441 HG13 ' CH2' ' A' ' 29' ' ' TRP . 2.1 p -103.97 121.72 55.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 108.428 -0.953 . . . . 0.22 108.428 166.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.489 ' HA ' HG12 ' A' ' 8' ' ' ILE . 50.1 p -75.49 144.38 42.05 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.379 -0.373 . . . . 1.07 110.85 -175.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.438 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.96 -160.01 10.64 Favored Glycine 0 N--CA 1.437 -1.243 0 C-N-CA 120.256 -0.973 . . . . 0.11 113.527 -177.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.7 mm -126.12 132.19 70.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 N-CA-C 109.296 -0.631 . . . . 0.13 109.296 -177.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.553 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -102.37 136.39 34.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 120.684 0.278 . . . . 0.13 110.477 -175.664 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.24 127.26 25.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.92 0.391 . . . . 0.1 111.76 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.515 HD12 ' HA ' ' A' ' 3' ' ' HIS . 57.8 mt -86.11 135.51 24.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.757 -0.461 . . . . 0.27 109.757 176.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -110.32 106.72 16.2 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.164 -0.471 . . . . 1.24 110.989 -175.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.442 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 30.4 mt-10 -117.35 170.25 8.86 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.848 -0.797 . . . . 1.2 108.848 174.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.442 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 34.6 t70 78.04 -3.98 2.28 Favored 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 122.342 1.068 . . . . 0.58 109.737 -176.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' ' 23' ' ' SER . 32.9 m -103.09 -174.07 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.078 0 CA-C-N 113.96 -1.473 . . . . 0.25 109.651 179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.598 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.8 m -72.35 164.66 57.78 Favored Pre-proline 0 C--N 1.316 -0.868 0 N-CA-C 104.997 -2.223 . . . . 1.13 104.997 174.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.408 ' O ' HG13 ' A' ' 41' ' ' VAL . 82.2 Cg_exo -41.45 128.79 3.46 Favored 'Trans proline' 0 C--N 1.353 0.785 0 CA-C-N 120.949 1.374 . . . . 0.16 112.744 -141.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.493 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -47.66 141.3 5.46 Favored 'General case' 0 CA--C 1.508 -0.646 0 CA-C-N 113.919 -1.491 . . . . 0.1 112.703 -165.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -127.71 164.7 21.54 Favored 'General case' 0 N--CA 1.438 -1.057 0 CA-C-N 114.382 -1.281 . . . . 0.32 111.731 -169.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.719 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -115.48 105.44 12.81 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 107.55 -1.278 . . . . 0.09 107.55 173.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.0 m -100.39 106.71 18.33 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 120.941 0.4 . . . . 0.17 110.57 -176.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.441 ' CH2' HG13 ' A' ' 12' ' ' VAL . 82.7 t90 -84.67 131.72 34.55 Favored 'General case' 0 N--CA 1.443 -0.789 0 N-CA-C 108.801 -0.815 . . . . 0.14 108.801 172.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.561 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 36.8 mtm180 -122.66 160.86 24.93 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.824 -0.806 . . . . 1.91 108.824 175.455 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.1 p -72.38 178.1 4.18 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.995 -0.743 . . . . 0.6 108.995 175.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.438 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 5.1 p -60.43 -31.25 70.23 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.307 -0.557 . . . . 0.26 111.046 179.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -94.6 -24.27 17.29 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.785 0.802 . . . . 2.12 109.686 172.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.561 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 88.32 16.76 58.48 Favored Glycine 0 N--CA 1.446 -0.662 0 CA-C-N 114.762 -1.108 . . . . 0.23 111.591 -178.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -65.69 -41.43 92.39 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.052 -0.722 . . . . 1.73 109.052 175.285 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.6 tttt -91.98 140.86 29.24 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.03 -0.987 . . . . 1.3 108.361 171.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.482 HG23 ' HG2' ' A' ' 30' ' ' ARG . 11.1 p -148.48 135.96 13.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 CA-C-O 120.812 0.339 . . . . 0.17 110.639 -178.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -143.65 124.99 14.65 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.966 -0.383 . . . . 0.41 109.966 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 23.3 m -110.81 141.14 44.55 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 112.144 0.424 . . . . 0.15 112.144 -173.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.719 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -111.09 129.22 66.76 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.797 0 N-CA-C 108.037 -1.097 . . . . 0.12 108.037 168.163 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.46 ' O ' HG12 ' A' ' 45' ' ' ILE . 94.3 t -93.01 121.41 43.68 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 O-C-N 120.991 -1.068 . . . . 0.11 108.973 173.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.572 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -68.75 -21.22 64.38 Favored 'General case' 0 CA--C 1.516 -0.365 0 N-CA-C 113.098 0.777 . . . . 0.08 113.098 -169.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 17.1 p -68.23 -15.98 63.79 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.383 0.611 . . . . 0.87 109.386 175.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.482 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 5.1 p -111.18 14.29 21.78 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-N 115.395 -0.82 . . . . 0.15 110.079 -178.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.559 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.3 mm -112.41 139.05 39.13 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.961 -0.755 . . . . 0.12 108.961 177.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -105.23 -43.84 4.91 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.181 -0.463 . . . . 0.52 110.586 -175.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.465 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 26.7 mtpt -133.07 169.09 17.34 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-O 121.334 0.588 . . . . 1.41 111.292 -179.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.898 HD11 HD12 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -150.77 146.34 26.33 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.909 -1.041 . . . . 0.73 108.998 176.57 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.681 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 11.6 mm-40 -134.5 145.23 48.59 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.979 -0.378 . . . . 1.94 109.979 -173.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.593 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -142.12 132.69 25.32 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 118.135 0.425 . . . . 0.22 111.032 174.136 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.46 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 82.6 p -64.98 118.03 45.03 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.508 -0.769 . . . . 0.26 110.704 -176.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -54.86 160.23 7.99 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 123.057 2.505 . . . . 0.38 112.34 177.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -70.03 -12.87 61.92 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.06 -0.518 . . . . 0.66 111.438 -178.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.9 m -89.16 -19.23 25.73 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.219 0.533 . . . . 1.5 110.558 174.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.9 m -72.57 141.3 48.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.553 -0.749 . . . . 0.85 111.005 -179.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.5 -6.42 19.55 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 115.408 -0.815 . . . . 1.77 111.151 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.425 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 9.0 mptt -107.65 159.81 16.18 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.957 -1.02 . . . . 1.63 111.716 -175.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.46 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 3.1 mtp -131.91 98.3 4.41 Favored 'General case' 0 N--CA 1.438 -1.067 0 CA-C-N 114.636 -1.165 . . . . 1.11 108.778 168.657 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.446 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.1 OUTLIER -154.89 155.36 34.19 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.727 -0.67 . . . . 0.22 112.15 -172.364 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.511 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -135.11 119.05 17.36 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 114.659 -1.155 . . . . 0.1 108.302 177.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.7 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 6.4 mtp180 -104.25 138.04 41.29 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.232 0.539 . . . . 2.99 111.171 -178.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.922 HD21 HD13 ' A' ' 104' ' ' LEU . 1.6 mm? -115.9 106.02 13.34 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.34 -0.845 . . . . 0.13 109.252 176.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.545 HG13 ' HG2' ' A' ' 86' ' ' ARG . 3.0 mp -88.67 108.33 18.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 110.318 -0.253 . . . . 0.29 110.318 -173.6 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.587 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -63.58 157.82 40.81 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 121.135 -0.555 . . . . 0.54 112.659 179.14 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 82.8 mttt -75.52 147.14 39.98 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.018 0.437 . . . . 0.55 111.184 -179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.525 ' CG2' ' HG3' ' A' ' 84' ' ' PRO . 1.7 t -101.28 141.87 17.05 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 CA-C-N 115.782 -0.644 . . . . 1.73 111.13 -175.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.446 ' HB2' ' HD2' ' A' ' 70' ' ' LYS . 23.8 m-20 -107.18 81.8 1.59 Allowed 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.156 -1.053 . . . . 3.23 108.156 167.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -70.26 -2.84 14.56 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.249 0.547 . . . . 2.39 111.044 -174.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.3 p -91.37 -3.72 56.46 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.621 -0.718 . . . . 2.96 110.601 173.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 8.5 ptmm? -83.19 27.89 0.55 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.206 -0.452 . . . . 2.49 110.459 -177.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.544 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 29.3 mmtm -44.86 113.38 0.55 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.542 -0.754 . . . . 3.4 110.94 -170.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.527 ' HB3' HG23 ' A' ' 80' ' ' VAL . 72.3 ttt180 -98.04 165.93 11.67 Favored 'General case' 0 N--CA 1.436 -1.155 0 N-CA-C 108.174 -1.047 . . . . 3.8 108.174 178.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.595 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 63.1 mttp -134.01 140.83 46.96 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 109.704 -0.48 . . . . 4.29 109.704 172.57 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.479 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.5 OUTLIER -79.09 -172.07 2.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.642 -0.708 . . . . 4.41 110.057 -178.237 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.411 HD22 ' N ' ' A' ' 75' ' ' ASN . 0.9 OUTLIER -62.15 -31.84 72.38 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.616 0.246 . . . . 5.34 111.327 -179.109 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.479 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 26.0 mt-10 -78.79 -31.53 46.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.701 0.286 . . . . 5.38 110.798 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 114.65 17.09 7.16 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.786 -0.721 . . . . 4.37 112.635 178.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.595 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 38.1 m-80 -74.07 134.05 42.92 Favored 'General case' 0 CA--C 1.513 -0.462 0 N-CA-C 109.571 -0.529 . . . . 4.51 109.571 177.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -72.01 91.41 1.22 Allowed 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.568 -0.53 . . . . 4.28 109.568 178.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.535 ' HB ' ' HA ' ' B' ' 525' ' ' ASN . 27.2 m -93.25 100.76 11.77 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.902 0 CA-C-O 122.035 0.922 . . . . 3.1 109.885 -179.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.544 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.5 p -94.82 106.27 23.75 Favored Pre-proline 0 C--N 1.319 -0.73 0 CA-C-N 115.554 -0.748 . . . . 2.5 109.612 177.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.65 ' HA ' ' O ' ' B' ' 525' ' ' ASN . 36.6 Cg_exo -64.04 143.41 84.67 Favored 'Trans proline' 0 C--O 1.233 0.23 0 C-N-CA 123.366 2.711 . . . . 1.87 113.212 -171.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.572 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -87.67 167.79 19.37 Favored Pre-proline 0 C--N 1.324 -0.539 0 CA-C-N 114.795 -1.093 . . . . 2.74 110.331 -177.273 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.587 ' HB3' ' O ' ' A' ' 64' ' ' GLY . 11.3 Cg_exo -58.46 148.28 81.46 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 122.089 1.86 . . . . 0.84 112.837 -178.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -92.32 115.85 28.45 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.492 -0.777 . . . . 1.57 109.377 175.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.545 ' HG2' HG13 ' A' ' 63' ' ' ILE . 31.3 mtm-85 -104.67 120.96 42.56 Favored 'General case' 0 C--N 1.305 -1.366 0 CA-C-N 114.962 -1.017 . . . . 2.52 110.453 -172.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.568 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 52.9 m-70 -96.24 110.2 22.54 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.974 -0.75 . . . . 0.72 108.974 -176.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.7 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 24.1 ttm -108.27 118.97 38.16 Favored 'General case' 0 CA--C 1.51 -0.569 0 C-N-CA 119.898 -0.721 . . . . 0.27 111.341 -177.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.508 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.3 m-85 -109.53 128.54 55.27 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.2 -0.909 . . . . 0.27 109.905 179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.473 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.59 151.09 27.83 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 110.038 -0.356 . . . . 1.26 110.038 176.058 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.413 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 20.7 m-85 -130.54 174.43 9.9 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.362 0.601 . . . . 0.32 111.69 -173.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -115.42 -19.54 10.64 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.103 -0.953 . . . . 2.38 110.878 177.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.428 ' HB2' HG23 ' A' ' 96' ' ' VAL . 46.5 m-80 -142.61 133.56 25.71 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.423 0.63 . . . . 1.1 110.926 -178.306 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.504 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.7 mmm180 -61.46 -35.52 77.86 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 114.713 -1.131 . . . . 3.09 112.063 178.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 4.9 m -62.85 -34.14 76.73 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.735 0.302 . . . . 0.35 110.775 -177.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.548 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.0 t -69.2 -57.06 9.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.299 -0.41 . . . . 0.23 110.328 178.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.511 ' HA ' HD12 ' A' ' 60' ' ' LEU . 12.6 ptp -57.96 -38.69 76.49 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.056 -0.52 . . . . 0.17 111.39 -176.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 97' ' ' MET . 15.6 t70 -67.63 -37.46 82.49 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.996 -0.282 . . . . 0.34 110.297 179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.481 ' HA ' ' HE2' ' A' ' 102' ' ' MET . 4.2 m-80 -72.56 -43.03 64.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.242 -0.435 . . . . 1.36 111.163 178.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.655 HG22 HD11 ' A' ' 104' ' ' LEU . 32.4 mm -62.42 -56.62 16.41 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 N-CA-C 108.849 -0.797 . . . . 0.12 108.849 177.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.817 ' HA ' HD12 ' A' ' 104' ' ' LEU . 12.3 ttpp -51.34 -46.24 62.6 Favored 'General case' 0 C--O 1.22 -0.481 0 O-C-N 123.693 0.621 . . . . 0.79 110.112 177.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.646 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 38.2 ttp -50.3 -59.69 3.72 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 115.669 -0.696 . . . . 0.28 111.175 177.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.78 ' O ' HG13 ' A' ' 107' ' ' ILE . 35.5 m -57.39 -52.81 63.85 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.212 -0.449 . . . . 0.18 110.546 -178.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.922 HD13 HD21 ' A' ' 62' ' ' LEU . 26.4 mt -45.8 -55.35 6.7 Favored 'General case' 0 C--O 1.223 -0.336 0 O-C-N 123.685 0.615 . . . . 0.09 110.313 174.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.671 ' CG ' HD13 ' A' ' 48' ' ' LEU . 23.7 mt-30 -55.75 -43.93 77.13 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.877 -1.056 . . . . 1.2 112.484 177.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.646 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.4 mt-30 -62.12 -32.43 73.0 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.877 0.846 . . . . 2.37 108.862 179.707 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.78 HG13 ' O ' ' A' ' 103' ' ' THR . 9.8 mt -78.63 -46.68 24.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-N 114.284 -1.325 . . . . 0.15 111.116 -178.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.898 HD12 HD11 ' A' ' 48' ' ' LEU . 7.9 mt -61.8 -39.52 83.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.074 -0.512 . . . . 0.19 111.675 -177.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.0 t -60.17 -26.82 66.62 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.653 0.263 . . . . 1.14 111.065 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -65.64 -43.82 88.28 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.537 0.684 . . . . 1.64 109.249 174.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.408 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 29.7 m-85 -91.53 12.04 22.16 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.235 -0.893 . . . . 0.65 109.759 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? -94.53 -40.6 9.79 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.75 -1.113 . . . . 0.76 108.118 173.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -77.39 -28.48 52.81 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.802 -1.09 . . . . 2.27 110.39 174.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -101.12 30.76 3.95 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.996 -0.547 . . . . 1.2 111.203 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.408 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 20.4 t70 . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.269 -0.872 . . . . 2.72 109.776 178.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.661 0 N-CA-C 111.932 -0.467 . . . . 19.89 111.932 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 50.9 m 53.86 72.24 1.17 Allowed Pre-proline 0 C--O 1.234 0.285 0 CA-C-O 121.213 0.53 . . . . 18.33 111.424 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 75.0 Cg_endo -81.63 160.53 19.25 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 122.871 2.381 . . . . 17.39 112.045 -178.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -82.11 2.16 84.96 Favored Glycine 0 N--CA 1.449 -0.455 0 N-CA-C 111.421 -0.672 . . . . 16.36 111.421 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 62.58 72.64 0.59 Allowed Pre-proline 0 C--N 1.33 -0.281 0 C-N-CA 123.28 0.632 . . . . 16.0 111.327 177.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -87.28 22.09 0.97 Allowed 'Trans proline' 0 N--CA 1.459 -0.543 0 C-N-CA 122.957 2.438 . . . . 13.15 112.02 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . 0.65 ' O ' ' HA ' ' A' ' 82' ' ' PRO . 92.1 m-20 -80.43 55.44 2.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.908 -0.587 . . . . 12.36 110.57 -177.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 98.36 124.0 4.93 Favored Glycine 0 N--CA 1.444 -0.811 0 N-CA-C 111.054 -0.819 . . . . 9.63 111.054 -174.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 5.4 tt 67.83 90.96 0.09 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.302 0.572 . . . . 8.34 109.518 -174.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 3.0 tt -104.81 77.01 1.31 Allowed 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 108.26 -1.015 . . . . 10.41 108.26 174.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 16.0 m 57.33 66.63 1.11 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.343 -0.844 . . . . 7.62 110.703 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -99.98 -99.02 2.25 Favored Glycine 0 N--CA 1.444 -0.827 0 C-N-CA 120.545 -0.836 . . . . 5.19 112.394 -177.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -135.43 -11.95 2.11 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.332 0.587 . . . . 5.5 111.062 -176.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -105.39 22.4 15.5 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 122.214 1.007 . . . . 5.68 110.218 -178.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -66.65 -41.52 88.12 Favored 'General case' 0 C--N 1.306 -1.31 0 CA-C-N 113.986 -1.461 . . . . 3.22 111.736 -178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -68.96 -37.98 79.12 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.112 0.482 . . . . 4.27 110.592 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 3.2 p -76.04 -11.24 59.91 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.745 -0.661 . . . . 1.25 111.146 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 74.6 m -84.61 -37.62 20.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.183 0.516 . . . . 2.08 110.432 173.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . 0.434 HD13 ' HA ' ' B' ' 537' ' ' ILE . 23.3 mm -74.85 -34.36 33.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-O 121.035 0.445 . . . . 1.29 110.155 175.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -78.26 4.37 12.93 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.249 0.547 . . . . 0.76 110.76 175.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.413 ' HB2' ' NH1' ' A' ' 61' ' ' ARG . 28.0 t70 -90.18 -40.41 12.22 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.691 -0.686 . . . . 1.23 109.397 174.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 36.7 mtm -55.95 -32.23 63.67 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 115.171 -0.922 . . . . 2.29 109.857 174.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . 0.536 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 3.8 t70 -56.45 -44.16 80.2 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.716 -1.129 . . . . 1.18 110.749 177.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.3 -31.89 73.27 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.588 -0.733 . . . . 0.56 112.052 -171.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 10.3 t -64.89 -29.57 70.52 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.004 0.431 . . . . 1.58 110.357 -178.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -91.32 -8.54 47.85 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.086 -0.506 . . . . 0.84 110.838 178.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 78.3 mt -87.8 -37.22 16.77 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.262 -0.426 . . . . 1.08 112.018 -179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 82.8 mt -71.54 -37.71 71.12 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.463 0.649 . . . . 0.97 109.695 177.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 2.9 p -118.21 89.96 3.23 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.949 -1.023 . . . . 1.42 109.93 175.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -85.88 64.1 8.41 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.658 -0.701 . . . . 2.67 111.411 -173.1 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 37.9 pt -87.41 -8.5 11.01 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.944 -0.571 . . . . 5.23 110.69 178.36 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 48.2 p -98.61 -5.13 32.45 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.104 0.478 . . . . 6.4 110.296 176.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 14.1 m . . . . . 0 C--O 1.251 1.155 0 CA-C-O 118.858 -0.592 . . . . 7.59 110.139 -179.432 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo . . . . . 0 N--CA 1.479 0.662 0 N-CA-C 110.378 -0.662 . . . . 1.89 110.378 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.7 p -92.14 -74.7 0.51 Allowed 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.457 0.169 . . . . 2.05 111.457 -178.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.565 ' HA ' HD12 ' A' ' 18' ' ' ILE . 75.3 m80 62.19 6.83 1.95 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.21 0.604 . . . . 0.75 111.656 -174.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 p -158.68 165.86 33.39 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.085 -0.646 . . . . 1.09 112.171 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.499 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . 175.57 -165.77 36.78 Favored Glycine 0 N--CA 1.44 -1.081 0 CA-C-N 114.971 -1.013 . . . . 0.16 110.915 -179.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.3 134.1 46.13 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 117.153 0.476 . . . . 0.16 110.009 179.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.583 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -146.56 148.61 32.33 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.623 -0.262 . . . . 0.11 111.656 -176.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.802 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 61.6 mt -109.39 122.83 64.65 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.952 0.406 . . . . 0.33 110.719 176.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.414 ' O ' HG13 ' A' ' 12' ' ' VAL . 20.3 t80 -125.59 134.16 52.02 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.785 -0.82 . . . . 0.36 108.785 179.056 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 59.52 26.61 15.62 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 122.777 0.431 . . . . 0.8 110.543 -177.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt 69.56 1.06 3.19 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.825 0.85 . . . . 2.11 113.125 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.414 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.5 OUTLIER -92.45 123.77 44.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 108.418 -0.956 . . . . 0.22 108.418 167.842 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.3 m -75.9 145.77 40.24 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 120.901 0.381 . . . . 1.07 110.234 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -161.6 -160.82 11.17 Favored Glycine 0 N--CA 1.437 -1.297 0 C-N-CA 120.317 -0.944 . . . . 0.11 112.944 -177.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.5 mm -125.28 135.04 65.29 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 109.217 -0.661 . . . . 0.13 109.217 -178.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.595 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -104.08 135.5 41.56 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 110.133 -0.321 . . . . 0.13 110.133 -175.493 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.69 129.2 30.25 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.928 0.394 . . . . 0.1 111.594 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.565 HD12 ' HA ' ' A' ' 3' ' ' HIS . 58.5 mt -86.11 134.98 26.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 109.812 -0.44 . . . . 0.27 109.812 177.589 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -111.33 103.57 11.97 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 116.245 -0.434 . . . . 1.24 111.303 -173.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.455 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 30.9 mt-10 -114.95 170.32 8.43 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.435 -0.95 . . . . 1.2 108.435 173.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.455 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 27.1 t70 80.77 -5.84 1.69 Allowed 'General case' 0 N--CA 1.484 1.225 0 CA-C-O 122.393 1.092 . . . . 0.58 109.472 -176.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 23' ' ' SER . 26.4 m -102.74 -173.18 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.093 0 CA-C-N 113.732 -1.576 . . . . 0.25 109.107 178.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.627 ' O ' HG23 ' A' ' 22' ' ' VAL . 30.5 m -72.15 168.12 25.95 Favored Pre-proline 0 C--N 1.315 -0.908 0 N-CA-C 105.549 -2.019 . . . . 1.13 105.549 175.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.411 ' O ' HG13 ' A' ' 41' ' ' VAL . 68.8 Cg_exo -40.76 128.36 2.64 Favored 'Trans proline' 0 C--N 1.359 1.095 0 CA-C-N 121.288 1.496 . . . . 0.16 112.518 -145.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.517 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -49.24 140.39 9.9 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 114.215 -1.357 . . . . 0.1 112.534 -164.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -124.29 166.47 15.84 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.353 -1.294 . . . . 0.32 111.862 -170.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.768 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -115.84 107.3 14.85 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 107.633 -1.247 . . . . 0.09 107.633 173.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.1 m -104.16 106.94 17.62 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-O 120.82 0.343 . . . . 0.17 111.301 -174.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.424 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 86.2 t90 -85.21 130.44 34.6 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.942 -0.762 . . . . 0.14 108.942 172.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.454 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 61.4 mtt180 -125.16 156.7 37.98 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 108.77 -0.826 . . . . 1.91 108.77 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.4 p -66.0 174.47 2.47 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.301 -0.629 . . . . 0.6 109.301 178.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 5.1 p -58.02 -36.92 73.38 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 120.408 -0.517 . . . . 0.26 110.681 179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -87.67 -32.26 19.32 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.558 0.694 . . . . 2.12 109.716 172.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.454 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 100.29 12.78 37.93 Favored Glycine 0 N--CA 1.448 -0.519 0 CA-C-N 114.922 -1.036 . . . . 0.23 112.825 176.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -66.68 -36.53 82.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.36 0.6 . . . . 1.73 109.895 176.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -95.68 137.82 34.2 Favored 'General case' 0 CA--C 1.512 -0.496 0 N-CA-C 108.414 -0.958 . . . . 1.3 108.414 174.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 14.6 p -150.48 136.31 11.54 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 CA-C-O 120.994 0.426 . . . . 0.17 111.391 -177.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -143.71 128.8 18.64 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.634 -0.506 . . . . 0.41 109.634 177.601 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 30.4 m -114.37 140.86 48.31 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 112.033 0.383 . . . . 0.15 112.033 -172.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.768 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -107.89 128.97 62.77 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 N-CA-C 108.18 -1.044 . . . . 0.12 108.18 168.383 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.449 ' O ' HG12 ' A' ' 45' ' ' ILE . 99.8 t -92.3 118.78 38.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 O-C-N 121.228 -0.92 . . . . 0.11 108.963 173.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.568 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -67.56 -18.55 65.05 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 112.866 0.691 . . . . 0.08 112.866 -170.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.537 ' HA ' ' CG ' ' A' ' 111' ' ' TYR . 80.4 p -68.18 -18.3 64.56 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.177 -0.675 . . . . 0.87 109.177 176.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.9 p -109.99 13.21 23.45 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.886 -1.052 . . . . 0.15 110.206 -177.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.554 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 27.4 mm -111.63 140.47 30.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.054 -0.521 . . . . 0.12 109.657 179.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -106.86 -43.99 4.54 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.882 -0.599 . . . . 0.52 110.839 -175.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.537 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 40.4 mtpt -133.57 172.26 12.98 Favored 'General case' 0 CA--C 1.51 -0.568 0 CA-C-O 121.411 0.624 . . . . 1.41 111.537 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.657 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -151.08 148.95 28.94 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.939 -1.028 . . . . 0.73 108.882 174.8 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.515 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 5.4 mm-40 -136.34 153.36 51.16 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.381 -0.6 . . . . 1.94 109.381 -176.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.463 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -145.66 140.36 27.24 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 118.278 0.49 . . . . 0.22 110.917 176.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 76.2 p -71.08 118.21 63.56 Favored Pre-proline 0 C--O 1.234 0.258 0 CA-C-N 116.134 -0.485 . . . . 0.26 111.272 -176.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.466 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 17.4 Cg_exo -56.82 160.69 11.62 Favored 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 122.867 2.378 . . . . 0.38 112.299 177.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.56 -20.88 66.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.697 -0.683 . . . . 0.66 111.871 -178.097 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 49.8 m -85.9 -18.07 33.77 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.203 0.525 . . . . 1.5 111.067 178.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.466 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 35.1 m -68.93 143.34 54.48 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.527 -0.76 . . . . 0.85 112.263 -177.342 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -58.18 -26.76 63.15 Favored 'General case' 0 CA--C 1.511 -0.532 0 CA-C-N 114.639 -1.164 . . . . 1.77 110.975 171.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.518 ' HB3' ' HE1' ' A' ' 59' ' ' MET . 68.1 mmtt -91.73 153.05 19.89 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 113.948 -1.478 . . . . 1.63 111.984 -169.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.577 ' O ' ' HG3' ' A' ' 59' ' ' MET . 80.0 mmm -127.16 96.16 4.51 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.317 -0.994 . . . . 1.11 108.317 167.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.577 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -158.52 158.34 33.83 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.581 0.705 . . . . 0.22 112.226 -173.326 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.536 HD12 ' HA ' ' A' ' 97' ' ' MET . 2.4 tt -135.43 120.62 18.91 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.662 -1.154 . . . . 0.1 108.121 176.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.624 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 1.0 OUTLIER -102.94 146.34 28.47 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.307 0.575 . . . . 2.99 111.591 -177.697 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.938 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -125.62 106.18 9.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.847 -1.07 . . . . 0.13 108.952 179.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.537 ' HB ' ' HB2' ' A' ' 47' ' ' LYS . 3.4 mp -87.73 105.85 15.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-O 120.695 0.283 . . . . 0.29 110.532 -172.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.524 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -74.89 147.66 36.93 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 121.306 -0.474 . . . . 0.54 113.062 -177.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.554 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 90.1 mttt -66.98 127.62 33.24 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 122.922 0.489 . . . . 0.55 111.945 -178.228 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.655 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.6 t -120.23 142.1 37.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 115.792 -0.64 . . . . 1.73 110.658 177.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.617 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 4.7 m-20 -86.46 82.6 7.89 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.835 -0.802 . . . . 3.23 108.835 175.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -64.69 -6.34 7.65 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.328 0.492 . . . . 2.39 112.328 -172.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 13.0 p -69.39 -8.45 46.69 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.387 0.613 . . . . 2.96 110.106 172.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.617 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 18.2 ptpt -82.92 33.21 0.43 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.489 -0.778 . . . . 2.49 111.226 178.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 17.1 mtmm -46.63 114.21 0.78 Allowed 'General case' 0 CA--C 1.515 -0.398 0 N-CA-C 109.277 -0.638 . . . . 3.4 109.277 -177.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.51 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.8 ttt180 -96.65 161.55 13.84 Favored 'General case' 0 N--CA 1.441 -0.897 0 CA-C-N 115.012 -0.994 . . . . 3.8 109.005 -168.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.57 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 98.8 mttt -129.23 146.56 51.11 Favored 'General case' 0 C--N 1.312 -1.039 0 N-CA-C 109.669 -0.493 . . . . 4.29 109.669 173.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.476 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 1.1 p-10 -81.48 -168.85 2.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.993 -0.549 . . . . 4.41 110.52 -177.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -59.37 -32.04 69.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.665 -0.243 . . . . 5.34 111.629 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.476 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 16.5 mt-10 -82.67 -41.51 19.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.093 0.473 . . . . 5.38 110.648 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 127.12 16.0 2.45 Favored Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.737 -0.744 . . . . 4.37 112.145 -178.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.57 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 37.1 m-80 -73.11 138.18 45.65 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.63 -0.507 . . . . 4.51 109.63 178.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -75.14 93.32 2.77 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 116.203 -0.453 . . . . 4.28 110.401 -177.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.51 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 14.7 m -103.91 99.45 8.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.855 0 CA-C-O 121.466 0.65 . . . . 3.1 109.309 177.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.471 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 p -92.41 111.84 52.49 Favored Pre-proline 0 C--N 1.316 -0.889 0 CA-C-O 121.366 0.603 . . . . 2.5 110.655 -177.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 39.1 Cg_exo -62.39 132.81 40.02 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 123.114 2.543 . . . . 1.87 112.082 -178.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.438 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 48.0 mtmt -94.02 161.55 29.46 Favored Pre-proline 0 C--N 1.316 -0.876 0 CA-C-N 115.174 -0.921 . . . . 2.74 109.655 -179.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.655 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 32.4 Cg_exo -48.24 146.09 10.28 Favored 'Trans proline' 0 N--CA 1.458 -0.572 0 C-N-CA 122.55 2.167 . . . . 0.84 112.323 179.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -90.04 115.85 27.63 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.491 -0.777 . . . . 1.57 109.891 -173.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.524 ' HG2' HG13 ' A' ' 63' ' ' ILE . 62.5 mtt180 -98.99 126.48 44.7 Favored 'General case' 0 C--N 1.303 -1.447 0 CA-C-N 115.237 -0.892 . . . . 2.52 110.963 -171.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.515 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 75.1 m-70 -94.55 147.54 23.17 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 107.217 -1.401 . . . . 0.72 107.217 177.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.624 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 26.6 ttm -141.94 131.84 24.41 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 119.033 0.833 . . . . 0.27 111.204 175.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.529 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.5 m-85 -120.97 134.64 55.3 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.471 -0.786 . . . . 0.27 109.529 178.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.802 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -79.99 159.39 26.27 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.507 -0.553 . . . . 1.26 109.507 178.071 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.438 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 16.7 m-85 -138.4 175.16 9.81 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.349 0.595 . . . . 0.32 112.151 -177.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 32.1 p-10 -116.94 -20.55 9.34 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.111 -0.95 . . . . 2.38 110.843 178.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -145.87 143.77 29.81 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.91 0.385 . . . . 1.1 110.451 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.544 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 0.2 OUTLIER -73.84 -28.56 61.66 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.831 -0.622 . . . . 3.09 111.835 -176.739 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 41.3 m -63.9 -38.53 91.41 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.757 0.313 . . . . 0.35 110.823 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.528 ' O ' HG12 ' A' ' 100' ' ' ILE . 12.2 t -63.55 -56.85 14.6 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.36 0 CA-C-N 116.324 -0.398 . . . . 0.23 110.273 178.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.544 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 15.7 ptp -58.58 -39.54 80.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.834 -0.621 . . . . 0.17 111.21 -176.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.7 -41.0 98.9 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 120.675 -0.41 . . . . 0.34 110.331 177.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -71.17 -39.29 71.97 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.271 -0.422 . . . . 1.36 111.71 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.638 HG22 HD11 ' A' ' 104' ' ' LEU . 34.2 mm -64.99 -56.2 16.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 N-CA-C 108.858 -0.793 . . . . 0.12 108.858 175.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.804 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.8 ttpt -51.57 -45.62 63.16 Favored 'General case' 0 C--O 1.223 -0.293 0 O-C-N 123.911 0.757 . . . . 0.79 110.232 177.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.486 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 41.3 ttp -51.87 -54.18 32.06 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.28 -0.873 . . . . 0.28 111.099 177.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.726 ' O ' HG13 ' A' ' 107' ' ' ILE . 24.4 m -62.33 -52.16 64.76 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.179 -0.464 . . . . 0.18 110.395 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.938 HD13 HD21 ' A' ' 62' ' ' LEU . 27.0 mt -46.97 -54.5 10.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.737 -0.665 . . . . 0.09 110.522 175.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.584 ' CG ' HD13 ' A' ' 48' ' ' LEU . 43.8 mt-30 -52.59 -46.39 66.92 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.826 -1.079 . . . . 1.2 112.239 176.595 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 102' ' ' MET . 13.7 mm100 -64.14 -27.93 69.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.671 0.748 . . . . 2.37 110.287 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.726 HG13 ' O ' ' A' ' 103' ' ' THR . 7.2 mt -81.08 -41.05 18.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 CA-C-N 114.737 -1.119 . . . . 0.15 110.798 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.657 HD12 HD11 ' A' ' 48' ' ' LEU . 6.3 mt -67.29 -38.63 81.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.354 -0.385 . . . . 0.19 111.84 -178.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 2.2 p -59.97 -24.92 64.81 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.014 0.435 . . . . 1.14 111.202 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 -62.25 -52.31 64.25 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.608 0.718 . . . . 1.64 109.55 172.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.567 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 21.5 m-85 -85.7 18.37 2.9 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.02 -0.991 . . . . 0.65 110.472 177.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.7 tpmt? -102.78 -41.51 6.17 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 107.842 -1.17 . . . . 0.76 107.842 171.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -72.44 -32.86 66.64 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.975 -1.011 . . . . 2.27 109.969 172.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -115.71 68.09 0.71 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.466 -0.788 . . . . 1.2 110.431 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.567 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 31.6 t70 . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.463 -0.779 . . . . 2.72 110.577 178.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.716 0 N-CA-C 111.992 -0.443 . . . . 19.89 111.992 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 61.4 m -130.66 88.7 45.84 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-O 120.922 0.392 . . . . 18.33 110.734 179.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -77.99 -21.76 10.6 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.551 2.167 . . . . 17.39 112.155 177.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 121.68 -166.82 14.42 Favored Glycine 0 N--CA 1.444 -0.818 0 N-CA-C 111.429 -0.668 . . . . 16.36 111.429 -176.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 73.7 m-85 -110.55 104.04 55.25 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-O 120.706 0.289 . . . . 16.0 110.706 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.11 168.45 21.87 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.578 2.185 . . . . 13.15 112.077 178.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -97.73 61.83 1.61 Allowed 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.103 -0.499 . . . . 12.36 110.747 -179.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -78.32 55.17 4.02 Favored Glycine 0 N--CA 1.45 -0.416 0 CA-C-N 115.844 -0.616 . . . . 9.63 112.181 179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 9.7 tt -146.58 -43.98 0.19 Allowed 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 121.959 0.885 . . . . 8.34 109.599 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 97.4 mt -78.67 -4.84 51.06 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 114.136 -1.393 . . . . 10.41 110.451 176.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 20.9 p -141.18 -74.11 0.33 Allowed 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.367 -0.833 . . . . 7.62 110.773 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 164.43 -84.23 0.11 Allowed Glycine 0 CA--C 1.499 -0.934 0 N-CA-C 110.959 -0.857 . . . . 5.19 110.959 176.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -146.03 9.53 1.13 Allowed 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 114.532 -0.834 . . . . 5.5 110.344 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -87.03 -2.47 58.65 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-O 121.727 0.775 . . . . 5.68 110.993 179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -80.9 3.39 22.91 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.615 -1.175 . . . . 3.22 110.582 -176.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 29.6 p90 -63.33 -22.88 67.15 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.62 0.724 . . . . 4.27 109.531 175.578 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 34.7 p -74.7 -21.48 59.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 114.795 -1.093 . . . . 1.25 110.387 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . 0.47 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 31.5 t -74.64 -36.53 62.88 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-O 121.235 0.54 . . . . 2.08 110.137 178.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 31.3 mm -74.63 -41.09 48.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.949 -0.569 . . . . 1.29 110.186 176.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -74.94 5.58 4.98 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.665 0.745 . . . . 0.76 110.512 176.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.524 ' HB2' ' NH1' ' A' ' 61' ' ' ARG . 34.8 t70 -92.18 -44.96 8.5 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.117 -0.947 . . . . 1.23 109.653 174.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 33.0 mtm -59.84 -31.96 70.22 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.052 -0.976 . . . . 2.29 109.491 174.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -51.41 -48.24 62.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 114.593 -1.185 . . . . 1.18 110.648 174.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -60.52 -35.53 76.2 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.324 -0.853 . . . . 0.56 112.164 -173.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 13.3 t -62.5 -46.43 88.47 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.85 0.357 . . . . 1.58 110.804 -175.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -77.35 -21.83 52.74 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.096 0.474 . . . . 0.84 110.255 177.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 18.1 tp -75.6 -37.83 59.53 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.58 -0.736 . . . . 1.08 111.2 -175.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 85.5 mt -75.68 -25.31 56.62 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 121.553 0.692 . . . . 0.97 109.386 174.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 16.3 m -87.98 31.67 0.78 Allowed 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.974 -1.012 . . . . 1.42 110.896 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -91.39 -16.76 26.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.395 0.617 . . . . 2.67 110.548 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 1.1 tp -101.25 123.26 54.21 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.072 0 CA-C-N 115.344 -0.844 . . . . 5.23 110.207 -178.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 13.8 t 60.42 79.74 0.23 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.625 -0.716 . . . . 6.4 110.96 177.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 69.4 m . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.335 -0.841 . . . . 7.59 110.612 178.343 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo . . . . . 0 C--O 1.232 0.202 0 N-CA-C 110.558 -0.593 . . . . 1.89 110.558 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 m -64.11 107.79 1.37 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.584 0.707 . . . . 2.05 111.794 -174.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.574 ' CD2' HG21 ' A' ' 103' ' ' THR . 56.2 m80 -89.67 8.26 32.46 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.07 -0.968 . . . . 0.75 109.624 171.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.9 p -157.71 168.54 26.93 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 119.604 -0.839 . . . . 1.09 112.785 -176.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.448 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 173.54 -163.43 34.74 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 110.116 -1.194 . . . . 0.16 110.116 -178.339 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -100.29 135.66 41.38 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 117.513 0.657 . . . . 0.16 110.167 177.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -145.43 152.27 39.56 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.42 -0.355 . . . . 0.11 110.859 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.41 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 79.0 mt -111.7 122.21 65.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 116.446 -0.343 . . . . 0.33 110.465 178.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.505 ' O ' HG13 ' A' ' 12' ' ' VAL . 32.4 t80 -126.17 132.6 51.78 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 109.218 -0.66 . . . . 0.36 109.218 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 58.98 28.16 17.3 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.037 0.535 . . . . 0.8 110.328 -176.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt 69.34 0.77 3.01 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 113.015 0.746 . . . . 2.11 113.015 178.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.505 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -91.45 121.69 42.14 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 108.047 -1.094 . . . . 0.22 108.047 167.077 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.7 m -75.61 145.22 41.29 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.095 -0.502 . . . . 1.07 110.21 -177.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.46 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -161.33 -156.81 8.46 Favored Glycine 0 N--CA 1.436 -1.363 0 C-N-CA 120.078 -1.058 . . . . 0.11 113.482 -177.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 15.8 mm -125.44 132.31 71.15 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 C-N-CA 123.217 0.607 . . . . 0.13 109.429 -177.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.572 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.73 135.96 38.95 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 109.704 -0.48 . . . . 0.13 109.704 -177.483 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.87 130.87 32.37 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.808 0.337 . . . . 0.1 111.264 -179.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.513 ' CD1' ' HB ' ' A' ' 103' ' ' THR . 52.8 mt -86.16 138.12 19.64 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 N-CA-C 109.685 -0.487 . . . . 0.27 109.685 177.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -111.22 103.16 11.55 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.137 -0.483 . . . . 1.24 111.091 -174.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 31.1 mt-10 -115.94 170.36 8.54 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.163 -0.68 . . . . 1.2 109.163 175.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.424 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 26.5 t70 77.26 -3.28 2.49 Favored 'General case' 0 N--CA 1.479 1.004 0 CA-C-O 122.37 1.081 . . . . 0.58 109.583 -178.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.625 HG23 ' O ' ' A' ' 23' ' ' SER . 32.8 m -103.0 -173.92 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.046 0 CA-C-N 113.885 -1.507 . . . . 0.25 109.798 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.625 ' O ' HG23 ' A' ' 22' ' ' VAL . 53.6 m -73.01 166.52 42.72 Favored Pre-proline 0 C--N 1.315 -0.896 0 N-CA-C 105.211 -2.144 . . . . 1.13 105.211 173.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_exo -41.34 128.52 3.26 Favored 'Trans proline' 0 C--N 1.355 0.902 0 CA-C-N 121.037 1.406 . . . . 0.16 112.738 -141.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.498 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -50.21 142.18 10.26 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 114.105 -1.407 . . . . 0.1 112.593 -165.317 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -127.74 169.4 13.89 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 114.447 -1.251 . . . . 0.32 111.985 -168.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -120.46 107.25 12.66 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 107.939 -1.134 . . . . 0.09 107.939 174.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.8 m -101.42 108.53 20.16 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 116.427 -0.351 . . . . 0.17 111.193 -175.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.494 ' HH2' ' HG ' ' A' ' 31' ' ' SER . 87.8 t90 -85.3 131.13 34.46 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.853 -0.795 . . . . 0.14 108.853 170.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.545 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 89.1 mtt180 -122.26 151.12 41.41 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.628 -0.878 . . . . 1.91 108.628 172.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.672 ' OG ' ' HB3' ' A' ' 36' ' ' LYS . 2.8 m -61.99 172.49 1.36 Allowed 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 110.16 -0.311 . . . . 0.6 110.16 173.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.46 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.1 p -60.02 -36.13 76.58 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.218 -0.593 . . . . 0.26 110.62 178.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -86.17 -14.68 43.33 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.397 -0.594 . . . . 2.12 109.397 175.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.545 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 76.99 19.51 77.35 Favored Glycine 0 N--CA 1.447 -0.574 0 CA-C-N 115.147 -0.933 . . . . 0.23 112.513 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -84.37 -35.43 23.19 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.533 -0.914 . . . . 1.73 108.533 -178.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.672 ' HB3' ' OG ' ' A' ' 31' ' ' SER . 43.7 tttp -90.68 141.09 29.15 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 114.18 -1.373 . . . . 1.3 108.59 172.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.491 HG23 ' HG2' ' A' ' 30' ' ' ARG . 9.5 p -150.28 138.56 14.52 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 C-N-CA 120.834 -0.346 . . . . 0.17 111.066 -176.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -145.07 125.02 13.48 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.973 -0.38 . . . . 0.41 109.973 175.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 31.7 m -110.67 137.11 48.76 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.104 0.409 . . . . 0.15 112.104 -174.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.37 129.53 56.58 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 N-CA-C 108.117 -1.068 . . . . 0.12 108.117 168.636 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 87.9 t -93.15 121.66 44.02 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.047 0 O-C-N 121.23 -0.919 . . . . 0.11 108.926 173.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.592 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -68.71 -18.56 64.27 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.104 0.779 . . . . 0.08 113.104 -169.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.7 p -72.0 -11.93 61.0 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 120.066 -0.654 . . . . 0.87 109.75 175.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.2 p -111.31 13.07 21.66 Favored 'General case' 0 N--CA 1.445 -0.712 0 CA-C-N 115.345 -0.843 . . . . 0.15 109.624 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.553 HG21 HD13 ' A' ' 62' ' ' LEU . 26.8 mm -113.75 138.04 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-N 115.712 -0.676 . . . . 0.12 109.25 177.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -101.75 -42.56 6.13 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 116.094 -0.503 . . . . 0.52 110.456 -177.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.4 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 15.0 mtmm -142.17 172.7 12.33 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.306 -0.407 . . . . 1.41 111.012 -176.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.844 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -151.01 149.04 29.09 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.591 -0.892 . . . . 0.73 108.591 179.739 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.463 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 16.5 mm-40 -138.64 127.76 24.09 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 110.453 -0.203 . . . . 1.94 110.453 -175.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.587 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -122.01 134.85 54.8 Favored 'General case' 0 C--N 1.326 -0.413 0 O-C-N 121.452 -0.78 . . . . 0.22 110.968 176.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.458 ' HB ' ' OG ' ' A' ' 55' ' ' SER . 69.1 p -63.37 115.39 17.71 Favored Pre-proline 0 C--O 1.234 0.247 0 CA-C-N 115.913 -0.585 . . . . 0.26 110.409 -175.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 51' ' ' THR . 2.2 Cg_endo -54.98 158.95 10.31 Favored 'Trans proline' 0 C--N 1.346 0.401 0 C-N-CA 122.953 2.436 . . . . 0.38 112.046 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.94 -11.76 49.79 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.273 -0.421 . . . . 0.66 111.382 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.0 t -109.4 25.9 11.26 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.24 0.543 . . . . 1.5 110.358 176.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.555 ' HB2' HD13 ' B' ' 545' ' ' LEU . 83.9 p -99.98 158.83 15.54 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.746 -0.464 . . . . 0.85 109.746 176.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -82.84 12.68 4.55 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 121.298 0.571 . . . . 1.77 110.516 175.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.523 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 42.9 mmtm -130.6 162.97 28.16 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.539 -0.755 . . . . 1.63 111.271 -171.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.438 ' O ' ' HG3' ' A' ' 59' ' ' MET . 3.5 mtp -136.9 97.95 3.65 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 114.997 -1.001 . . . . 1.11 108.826 167.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.523 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -156.81 155.13 31.01 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.556 -0.747 . . . . 0.22 111.41 -171.557 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.596 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.6 tt -131.94 119.03 20.57 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.383 -0.969 . . . . 0.1 108.383 176.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.612 ' NE ' ' HB2' ' A' ' 88' ' ' MET . 6.9 mtp180 -102.82 146.04 28.87 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 121.423 0.63 . . . . 2.99 111.325 -179.011 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.941 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -125.63 104.72 8.53 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 114.524 -1.216 . . . . 0.13 108.787 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.532 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.0 mp -85.66 102.3 11.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-O 120.724 0.297 . . . . 0.29 110.315 -172.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.48 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -63.94 152.96 48.18 Favored Glycine 0 N--CA 1.446 -0.634 0 CA-C-N 115.854 -0.612 . . . . 0.54 112.455 178.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.453 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 76.8 mttt -75.5 115.25 14.97 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-O 121.436 0.636 . . . . 0.55 112.509 -175.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.694 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 3.9 t -123.15 137.76 55.45 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.14 0 CA-C-N 114.98 -1.009 . . . . 1.73 110.1 172.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.515 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 34.4 m-20 -99.24 91.47 4.98 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 108.359 -0.978 . . . . 3.23 108.359 173.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 82' ' ' PRO . 46.2 mt-10 -64.86 -1.18 1.82 Allowed 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 112.651 0.611 . . . . 2.39 112.651 -171.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.3 p -72.75 -9.18 58.35 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.401 0.62 . . . . 2.96 109.94 168.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.603 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 11.6 ptmm? -80.03 41.79 0.53 Allowed 'General case' 0 C--O 1.239 0.528 0 CA-C-N 115.261 -0.882 . . . . 2.49 111.051 179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.418 ' HE2' ' OE1' ' A' ' 79' ' ' GLU . 18.9 mttp -43.41 117.39 1.11 Allowed 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.562 -0.744 . . . . 3.4 111.411 -175.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.566 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 25.7 ttt180 -101.47 158.87 15.75 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.15 -0.932 . . . . 3.8 109.118 -175.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 94.1 mttt -131.54 146.67 52.33 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 109.361 -0.607 . . . . 4.29 109.361 171.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.466 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 0.6 OUTLIER -76.62 -174.33 2.92 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.194 -0.457 . . . . 4.41 110.229 -178.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -56.65 -32.94 65.85 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 111.801 0.297 . . . . 5.34 111.801 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.466 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 21.5 mt-10 -81.02 -46.52 14.91 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.833 0.349 . . . . 5.38 110.823 -178.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 135.01 13.66 1.17 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.669 -0.776 . . . . 4.37 112.494 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.416 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 37.8 m-80 -71.1 129.01 37.85 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.402 -0.592 . . . . 4.51 109.402 177.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.418 ' OE1' ' HE2' ' A' ' 71' ' ' LYS . 35.4 tt0 -70.05 101.85 1.91 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.099 0.476 . . . . 4.28 110.083 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.566 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 10.1 m -113.88 98.76 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.911 0 CA-C-O 121.818 0.818 . . . . 3.1 109.017 177.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.448 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 0.5 OUTLIER -87.74 112.64 50.09 Favored Pre-proline 0 C--N 1.311 -1.104 0 CA-C-N 115.762 -0.653 . . . . 2.5 110.035 -177.846 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.481 ' O ' ' HG2' ' A' ' 68' ' ' GLU . 31.7 Cg_exo -63.39 132.52 36.23 Favored 'Trans proline' 0 CA--C 1.511 -0.628 0 C-N-CA 123.152 2.568 . . . . 1.87 112.636 -176.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -91.82 162.16 31.8 Favored Pre-proline 0 C--N 1.311 -1.082 0 CA-C-N 114.779 -1.1 . . . . 2.74 108.244 174.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.694 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 36.8 Cg_exo -55.89 147.39 62.74 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 121.944 1.763 . . . . 0.84 111.772 179.339 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -90.16 114.22 26.14 Favored 'General case' 0 CA--C 1.501 -0.915 0 CA-C-O 121.706 0.765 . . . . 1.57 109.137 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.438 ' HG2' HG13 ' A' ' 63' ' ' ILE . 94.0 mtt180 -104.89 125.75 51.24 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 114.999 -1.0 . . . . 2.52 110.282 -171.232 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.596 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 75.2 m-70 -94.04 144.8 25.16 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 107.022 -1.473 . . . . 0.72 107.022 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.612 ' HB2' ' NE ' ' A' ' 61' ' ' ARG . 25.2 ttm -139.99 124.96 18.51 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 119.056 0.844 . . . . 0.27 111.047 176.553 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.425 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.6 m-85 -113.95 128.72 56.52 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.166 -0.925 . . . . 0.27 109.443 178.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.449 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.6 OUTLIER -80.99 151.59 28.38 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.92 -0.4 . . . . 1.26 109.92 176.771 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.402 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 24.3 m-85 -132.75 173.37 11.43 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.057 0.455 . . . . 0.32 110.809 -176.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -124.9 -6.29 7.34 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.5 -0.773 . . . . 2.38 109.424 172.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.412 ' HB2' HG23 ' A' ' 96' ' ' VAL . 49.2 m-80 -136.55 120.4 17.45 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.953 -0.567 . . . . 1.1 110.882 -175.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.486 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.0 mmm180 -64.0 -35.58 81.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.344 -0.844 . . . . 3.09 111.872 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 17.2 m -63.17 -36.62 84.24 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.448 -0.342 . . . . 0.35 110.883 -177.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.591 ' O ' HG12 ' A' ' 100' ' ' ILE . 16.5 t -67.1 -57.19 10.8 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.378 0 CA-C-N 116.47 -0.332 . . . . 0.23 110.203 178.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.596 ' HA ' HD12 ' A' ' 60' ' ' LEU . 12.9 ptp -56.59 -37.84 71.19 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.091 -0.504 . . . . 0.17 111.363 -175.208 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -66.55 -43.18 85.78 Favored 'General case' 0 C--N 1.322 -0.611 0 C-N-CA 120.602 -0.439 . . . . 0.34 110.765 177.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -69.5 -41.49 76.02 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.447 -0.342 . . . . 1.36 111.471 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.638 HG22 HD11 ' A' ' 104' ' ' LEU . 30.1 mm -62.45 -57.41 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.468 0 N-CA-C 108.685 -0.857 . . . . 0.12 108.685 176.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.823 ' HA ' HD12 ' A' ' 104' ' ' LEU . 23.4 ttpp -50.12 -49.56 51.4 Favored 'General case' 0 C--O 1.218 -0.583 0 O-C-N 123.902 0.751 . . . . 0.79 110.164 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.699 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 37.4 ttp -48.76 -59.8 3.25 Favored 'General case' 0 CA--C 1.513 -0.478 0 O-C-N 123.961 0.788 . . . . 0.28 111.391 177.428 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.782 ' O ' HG13 ' A' ' 107' ' ' ILE . 36.0 m -57.76 -50.46 73.17 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.304 -0.407 . . . . 0.18 110.335 -178.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.941 HD13 HD21 ' A' ' 62' ' ' LEU . 35.3 mt -46.81 -55.77 7.38 Favored 'General case' 0 C--O 1.221 -0.404 0 O-C-N 123.744 0.652 . . . . 0.09 110.278 174.052 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.827 ' HG2' HD13 ' A' ' 48' ' ' LEU . 51.2 mt-30 -54.52 -44.95 73.21 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.913 -1.04 . . . . 1.2 112.134 177.236 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.699 ' HG3' ' O ' ' A' ' 102' ' ' MET . 22.6 mt-30 -61.82 -31.51 71.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.847 0.832 . . . . 2.37 108.956 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.782 HG13 ' O ' ' A' ' 103' ' ' THR . 8.6 mt -80.99 -43.75 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 114.584 -1.189 . . . . 0.15 111.163 -178.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.844 HD12 HD11 ' A' ' 48' ' ' LEU . 9.0 mt -63.95 -37.52 80.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 116.164 -0.471 . . . . 0.19 111.638 -177.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 39.6 t -55.4 -30.92 61.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.283 -0.417 . . . . 1.14 110.782 179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 80.4 mtt180 -62.47 -41.61 98.89 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.264 0.554 . . . . 1.64 109.732 176.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.51 ' O ' ' HB2' ' A' ' 115' ' ' ASP . 23.7 m-85 -97.73 18.73 15.0 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.701 -0.682 . . . . 0.65 109.963 179.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.1 -46.78 4.0 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.926 -1.138 . . . . 0.76 107.926 176.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -75.54 -13.96 60.38 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 114.577 -1.192 . . . . 2.27 109.993 172.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -128.88 71.88 1.44 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.424 -0.807 . . . . 1.2 110.195 176.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.51 ' HB2' ' O ' ' A' ' 111' ' ' TYR . 31.3 t70 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.41 -0.805 . . . . 2.72 109.968 178.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.603 0 N-CA-C 111.431 -0.668 . . . . 19.89 111.431 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 15.3 t -94.91 121.35 62.86 Favored Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 110.003 -0.369 . . . . 18.33 110.003 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.23 72.58 4.75 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 123.112 2.541 . . . . 17.39 112.655 -178.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -179.93 -67.07 0.07 OUTLIER Glycine 0 N--CA 1.445 -0.701 0 C-N-CA 121.066 -0.588 . . . . 16.36 111.994 178.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -140.37 141.09 24.67 Favored Pre-proline 0 C--N 1.323 -0.544 0 N-CA-C 110.048 -0.353 . . . . 16.0 110.048 179.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -78.04 63.24 8.17 Favored 'Trans proline' 0 CA--C 1.531 0.342 0 C-N-CA 122.965 2.443 . . . . 13.15 112.815 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -81.28 149.9 28.77 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.019 -0.537 . . . . 12.36 109.702 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -98.08 92.74 1.29 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.777 -0.725 . . . . 9.63 112.611 -176.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.428 ' N ' HD13 ' B' ' 527' ' ' LEU . 0.0 OUTLIER -111.42 29.66 7.63 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.082 0.467 . . . . 8.34 110.856 177.579 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 60.0 tp -75.65 83.72 2.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.895 -0.593 . . . . 10.41 111.305 -175.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 37.0 m 64.23 25.41 13.58 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 115.544 -0.753 . . . . 7.62 112.551 172.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -95.63 -100.79 1.84 Allowed Glycine 0 N--CA 1.444 -0.815 0 C-N-CA 120.12 -1.038 . . . . 5.19 111.694 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -123.81 -28.6 3.8 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.827 0.822 . . . . 5.5 109.719 -178.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' B' ' 536' ' ' SER . 38.4 mt-10 -79.53 -9.31 59.59 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 114.662 -1.153 . . . . 5.68 109.449 178.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -63.96 -26.39 68.56 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 113.591 -1.641 . . . . 3.22 110.94 -177.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -102.07 -60.3 1.56 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.192 0.52 . . . . 4.27 111.435 -176.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 20.2 p -74.4 -19.86 60.26 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.621 -0.718 . . . . 1.25 112.753 -170.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . 0.437 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 50.4 m -79.76 -34.38 39.89 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 120.617 -0.433 . . . . 2.08 110.523 175.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 47.6 mm -73.75 -40.83 54.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.331 0.586 . . . . 1.29 109.727 176.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -78.85 -0.14 29.48 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.687 0.756 . . . . 0.76 110.394 177.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.5 ' HB2' ' NH1' ' A' ' 61' ' ' ARG . 10.7 t70 -86.76 -45.52 10.86 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.957 -1.02 . . . . 1.23 108.869 171.489 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 86.3 mtp -59.48 -34.5 72.64 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 114.64 -1.164 . . . . 2.29 110.011 174.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -57.53 -53.07 62.3 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.988 0.899 . . . . 1.18 110.022 173.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.444 ' HA ' HD12 ' B' ' 545' ' ' LEU . 0.2 OUTLIER -65.06 -45.91 83.38 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 114.057 -1.428 . . . . 0.56 111.727 -171.509 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 14.5 m -56.79 -28.24 61.05 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.982 -0.554 . . . . 1.58 112.152 -176.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -82.23 -20.91 36.74 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.372 -0.376 . . . . 0.84 110.929 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.555 HD13 ' HB2' ' A' ' 55' ' ' SER . 89.9 mt -78.86 -33.66 45.68 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 115.989 -0.55 . . . . 1.08 111.532 -176.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -63.16 -70.04 0.23 Allowed 'General case' 0 CA--C 1.509 -0.623 0 CA-C-O 121.752 0.786 . . . . 0.97 110.212 175.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 12.9 p -71.99 59.93 0.38 Allowed 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 114.201 -1.363 . . . . 1.42 112.251 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -98.48 7.22 46.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.108 0.48 . . . . 2.67 109.957 173.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 43.3 mt 61.52 66.75 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 115.208 -0.905 . . . . 5.23 109.764 -176.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 15.4 t -71.42 -39.65 70.93 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.271 -0.877 . . . . 6.4 110.125 -177.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 48.0 m . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.733 -0.651 . . . . 7.59 109.941 177.631 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo . . . . . 0 N--CA 1.478 0.595 0 N-CA-C 110.37 -0.666 . . . . 1.89 110.37 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.6 t -168.61 -41.14 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.938 0.399 . . . . 2.05 110.544 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.402 ' CD2' HG21 ' A' ' 103' ' ' THR . 76.0 m80 66.89 -11.37 0.26 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.696 -0.683 . . . . 0.75 112.664 178.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.4 p -149.03 171.89 15.64 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.214 -0.594 . . . . 1.09 112.592 -170.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.51 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 169.77 -160.31 33.32 Favored Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 115.041 -0.981 . . . . 0.16 110.744 -179.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.36 132.01 52.9 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 117.423 0.612 . . . . 0.16 110.315 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.538 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -143.82 147.43 34.1 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.566 -0.288 . . . . 0.11 111.709 -176.445 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.793 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 64.6 mt -104.44 133.59 48.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 120.874 0.369 . . . . 0.33 110.178 175.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -132.85 129.14 38.07 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 108.534 -0.913 . . . . 0.36 108.534 178.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 56.75 34.27 24.35 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 122.559 0.344 . . . . 0.8 110.977 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm 69.72 -3.98 1.54 Allowed 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 113.27 0.841 . . . . 2.11 113.27 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.2 p -92.2 118.03 36.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 108.664 -0.865 . . . . 0.22 108.664 170.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.9 m -75.06 145.79 42.06 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.02 -0.536 . . . . 1.07 110.337 -176.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -160.71 -160.99 11.07 Favored Glycine 0 N--CA 1.439 -1.161 0 C-N-CA 120.149 -1.024 . . . . 0.11 113.244 -177.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -124.66 132.38 71.4 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 N-CA-C 109.281 -0.637 . . . . 0.13 109.281 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.574 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.49 135.39 41.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 110.221 -0.288 . . . . 0.13 110.221 -175.327 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.6 130.42 27.95 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.625 -0.261 . . . . 0.1 111.499 179.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.465 HD13 ' HB ' ' A' ' 103' ' ' THR . 43.3 mt -85.55 137.48 20.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.384 0.611 . . . . 0.27 110.449 176.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 20.0 t30 -106.76 106.23 16.65 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.999 -1.0 . . . . 1.24 110.791 -176.014 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -118.86 169.05 10.2 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.502 -0.555 . . . . 1.2 109.502 175.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.7 t70 76.25 -0.73 3.05 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-O 122.381 1.086 . . . . 0.58 109.601 -177.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 23' ' ' SER . 33.9 m -103.55 -171.65 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 CA-C-N 113.7 -1.591 . . . . 0.25 109.869 178.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.63 ' O ' HG23 ' A' ' 22' ' ' VAL . 54.9 p -71.94 168.34 23.61 Favored Pre-proline 0 C--N 1.318 -0.775 0 N-CA-C 105.259 -2.126 . . . . 1.13 105.259 175.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 99.6 Cg_exo -42.73 128.29 4.94 Favored 'Trans proline' 0 C--N 1.355 0.92 0 CA-C-N 121.524 1.58 . . . . 0.16 112.059 -145.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.465 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.85 142.86 18.05 Favored 'General case' 0 CA--C 1.506 -0.713 0 CA-C-N 114.093 -1.412 . . . . 0.1 112.245 -162.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -127.47 168.48 14.84 Favored 'General case' 0 N--CA 1.439 -1.023 0 CA-C-N 114.534 -1.212 . . . . 0.32 112.133 -168.195 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.807 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -118.16 106.77 13.18 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 107.649 -1.241 . . . . 0.09 107.649 173.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.492 HG23 ' OG1' ' A' ' 39' ' ' THR . 6.9 m -102.96 107.2 17.92 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 120.998 0.428 . . . . 0.17 111.23 -176.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.8 t90 -85.02 131.39 34.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.716 -0.846 . . . . 0.14 108.716 171.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.47 ' HG2' HG23 ' A' ' 37' ' ' VAL . 60.8 mtt85 -126.43 158.83 34.98 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.918 -0.771 . . . . 1.91 108.918 174.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.0 p -68.15 176.33 2.76 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.669 -0.493 . . . . 0.6 109.669 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.5 p -58.78 -35.96 73.65 Favored 'General case' 0 C--N 1.321 -0.668 0 C-N-CA 120.524 -0.471 . . . . 0.26 111.538 -179.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -93.77 -28.74 15.74 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.301 -0.629 . . . . 2.12 109.301 172.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.439 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 101.2 17.41 22.52 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.313 -0.858 . . . . 0.23 113.198 174.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -66.12 -48.26 71.44 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.865 -0.42 . . . . 1.73 109.865 173.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 37.0 tttt -82.89 138.05 34.02 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.925 -0.768 . . . . 1.3 108.925 174.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.47 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.5 p -149.25 135.64 12.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 121.009 0.433 . . . . 0.17 111.157 -177.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -144.58 128.92 17.86 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.881 -0.415 . . . . 0.41 109.881 178.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.492 ' OG1' HG23 ' A' ' 28' ' ' THR . 47.0 m -117.86 137.96 52.43 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 112.343 0.497 . . . . 0.15 112.343 -172.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.807 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -104.68 130.7 55.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.56 0 N-CA-C 108.329 -0.989 . . . . 0.12 108.329 169.242 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.41 ' O ' HG12 ' A' ' 45' ' ' ILE . 94.5 t -93.13 120.43 42.51 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 O-C-N 121.305 -0.872 . . . . 0.11 108.702 172.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.627 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -67.83 -18.86 64.97 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.875 0.695 . . . . 0.08 112.875 -170.119 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.426 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 15.5 t -69.78 -13.57 62.35 Favored 'General case' 0 C--N 1.323 -0.565 0 C-N-CA 120.327 -0.549 . . . . 0.87 109.84 174.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.2 p -108.99 6.81 25.5 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.934 -0.575 . . . . 0.15 109.844 -179.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.6 HG21 ' CD1' ' A' ' 62' ' ' LEU . 32.2 mm -109.27 138.37 36.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.671 -0.695 . . . . 0.12 109.792 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -102.58 -45.91 4.9 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 115.805 -0.634 . . . . 0.52 110.631 -178.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.538 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 23.5 mtpp -133.21 173.77 11.09 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.368 0.604 . . . . 1.41 111.861 -176.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.823 HD11 HD12 ' A' ' 108' ' ' ILE . 0.2 OUTLIER -153.38 142.09 20.98 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.809 -1.087 . . . . 0.73 108.657 178.009 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.49 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 15.1 mm-40 -136.53 127.16 27.06 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 110.348 -0.241 . . . . 1.94 110.348 -174.152 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.427 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -121.92 135.2 54.86 Favored 'General case' 0 C--N 1.326 -0.423 0 O-C-N 121.548 -0.72 . . . . 0.22 111.583 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.425 HG21 ' CB ' ' A' ' 57' ' ' LYS . 80.0 p -64.9 119.03 54.71 Favored Pre-proline 0 N--CA 1.467 0.403 0 CA-C-N 115.909 -0.587 . . . . 0.26 110.949 -176.098 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.463 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 23.7 Cg_exo -55.56 159.36 11.15 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.859 2.372 . . . . 0.38 112.006 178.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.67 -14.89 63.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.91 -0.586 . . . . 0.66 110.721 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -93.58 -7.68 43.38 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.474 -0.785 . . . . 1.5 110.386 179.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.48 ' C ' ' H ' ' A' ' 57' ' ' LYS . 42.4 m -83.88 147.35 27.57 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.938 -0.574 . . . . 0.85 111.805 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -70.46 11.94 0.3 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.479 -0.782 . . . . 1.77 111.851 178.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.554 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 25.8 mmtp -127.03 157.96 38.21 Favored 'General case' 0 C--N 1.308 -1.198 0 CA-C-N 115.58 -0.737 . . . . 1.63 111.41 -171.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.539 ' O ' ' HG3' ' A' ' 59' ' ' MET . 70.8 mmm -130.94 96.36 4.04 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.017 -1.105 . . . . 1.11 108.017 165.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.554 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.0 OUTLIER -156.15 152.51 28.0 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.52 0.676 . . . . 0.22 111.891 -172.181 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.575 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.5 tt -131.67 119.62 21.63 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-N 114.665 -1.152 . . . . 0.1 108.453 178.094 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.523 ' NE ' ' HG2' ' A' ' 86' ' ' ARG . 7.6 mtp180 -102.24 144.24 31.01 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-O 121.122 0.487 . . . . 2.99 111.154 -178.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.937 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -122.88 111.81 17.1 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.167 -0.924 . . . . 0.13 109.228 179.349 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.669 HG13 ' CD ' ' A' ' 86' ' ' ARG . 2.8 mp -87.98 107.76 17.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 C-N-CA 122.462 0.305 . . . . 0.29 110.93 -171.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -71.96 143.75 35.37 Favored Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 121.216 -0.516 . . . . 0.54 112.241 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.434 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 78.1 mttt -68.85 125.68 27.36 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 113.221 0.823 . . . . 0.55 113.221 -174.335 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.679 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 2.4 t -120.75 133.42 67.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.368 -0.833 . . . . 1.73 110.182 170.16 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.607 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 24.1 m-20 -94.48 91.63 6.72 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.103 -1.073 . . . . 3.23 108.103 175.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -62.25 -3.8 1.49 Allowed 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.22 0.822 . . . . 2.39 113.22 -169.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.1 p -71.46 -12.2 61.27 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.134 0.492 . . . . 2.96 109.959 171.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.607 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 21.1 ptmt -76.4 42.91 0.29 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.693 0.797 . . . . 2.49 110.772 176.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 18.1 mmmt -45.33 115.67 0.97 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.689 -0.687 . . . . 3.4 110.827 -174.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.594 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 79.6 ttt180 -94.65 163.55 13.33 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.605 -0.725 . . . . 3.8 109.39 -172.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 93.7 mttt -130.74 146.19 52.14 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 109.882 -0.414 . . . . 4.29 109.882 173.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -88.82 -165.66 1.39 Allowed 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.477 -0.783 . . . . 4.41 110.781 -173.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.4 p-10 -66.13 -16.56 64.06 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.337 0.495 . . . . 5.34 112.337 -176.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.575 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 22.6 mt-10 -107.02 -8.0 16.73 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.866 0.365 . . . . 5.38 111.088 -178.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 95.72 14.32 47.2 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.529 -0.844 . . . . 4.37 112.21 -178.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.575 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 50.0 m-80 -71.28 138.9 49.74 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.899 -0.778 . . . . 4.51 108.899 176.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -76.0 100.55 4.93 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 121.123 0.487 . . . . 4.28 109.811 -179.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.594 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 11.0 m -114.24 106.27 20.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.292 0.567 . . . . 3.1 109.797 -177.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.476 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.8 t -80.19 128.13 74.3 Favored Pre-proline 0 C--N 1.316 -0.871 0 C-N-CA 120.307 -0.557 . . . . 2.5 110.497 -175.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 25.4 Cg_exo -69.39 138.45 39.04 Favored 'Trans proline' 0 CA--C 1.513 -0.563 0 C-N-CA 123.254 2.636 . . . . 1.87 112.099 -178.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm -94.23 146.04 30.86 Favored Pre-proline 0 N--CA 1.427 -1.59 0 CA-C-N 115.2 -0.909 . . . . 2.74 109.331 175.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.679 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 51.6 Cg_exo -50.46 152.24 9.02 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 122.419 2.079 . . . . 0.84 112.13 178.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -75.18 162.75 28.21 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.091 -0.959 . . . . 1.57 108.581 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.669 ' CD ' HG13 ' A' ' 63' ' ' ILE . 0.7 OUTLIER -154.5 116.77 4.28 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 122.025 0.917 . . . . 2.52 111.16 -176.408 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.537 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 87.3 m-70 -94.69 154.52 17.28 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 113.695 -1.593 . . . . 0.72 107.964 -178.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.436 ' HG3' ' HG2' ' A' ' 61' ' ' ARG . 28.0 ttm -141.22 135.47 30.76 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 118.627 0.649 . . . . 0.27 110.611 174.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.539 ' O ' ' HA ' ' A' ' 59' ' ' MET . 11.3 m-85 -126.34 134.74 51.0 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.044 -0.526 . . . . 0.27 109.724 174.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.793 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.8 OUTLIER -80.83 158.47 25.38 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.32 -0.622 . . . . 1.26 109.32 176.65 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.506 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 26.7 m-85 -140.16 171.25 14.43 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.896 0.379 . . . . 0.32 110.99 -178.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -121.94 -15.04 7.93 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.12 -0.491 . . . . 2.38 110.288 175.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.444 ' HB2' HG23 ' A' ' 96' ' ' VAL . 41.6 m-80 -135.86 122.16 20.48 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.238 0.542 . . . . 1.1 110.68 -177.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.544 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.8 mmm180 -59.86 -34.8 73.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.098 -0.956 . . . . 3.09 112.276 179.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.443 ' O ' ' HB2' ' A' ' 99' ' ' ASN . 19.2 m -61.96 -32.67 73.13 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.854 0.359 . . . . 0.35 110.567 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.635 ' O ' HG12 ' A' ' 100' ' ' ILE . 18.8 t -69.92 -58.8 4.53 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 CA-C-N 116.249 -0.432 . . . . 0.23 110.363 179.047 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.575 ' HA ' HD12 ' A' ' 60' ' ' LEU . 11.6 ptp -55.84 -37.76 69.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.088 -0.505 . . . . 0.17 111.261 -176.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.443 ' N ' ' HG3' ' A' ' 97' ' ' MET . 37.4 t70 -64.65 -48.23 75.57 Favored 'General case' 0 C--O 1.219 -0.536 0 C-N-CA 120.628 -0.429 . . . . 0.34 110.096 176.654 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.443 ' HB2' ' O ' ' A' ' 95' ' ' THR . 7.9 t-20 -63.42 -41.68 98.7 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 123.608 0.763 . . . . 1.36 111.409 -179.274 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.656 HG22 HD11 ' A' ' 104' ' ' LEU . 30.9 mm -63.97 -58.51 7.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.341 0 N-CA-C 109.278 -0.638 . . . . 0.12 109.278 178.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.851 ' HA ' HD12 ' A' ' 104' ' ' LEU . 23.5 ttpp -51.44 -47.86 62.92 Favored 'General case' 0 C--O 1.215 -0.729 0 O-C-N 123.785 0.678 . . . . 0.79 110.02 177.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.501 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.9 ttp -48.65 -54.38 14.93 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.238 -0.892 . . . . 0.28 111.255 176.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.734 ' O ' HG13 ' A' ' 107' ' ' ILE . 28.1 m -60.69 -55.2 36.11 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.835 -0.621 . . . . 0.18 110.205 178.608 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.937 HD13 HD21 ' A' ' 62' ' ' LEU . 30.7 mt -45.8 -55.03 7.09 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 115.391 -0.822 . . . . 0.09 110.613 176.333 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.761 ' HG2' HD13 ' A' ' 48' ' ' LEU . 49.8 mt-30 -53.36 -45.02 69.01 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.519 -1.219 . . . . 1.2 112.454 178.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.501 ' HG2' ' O ' ' A' ' 102' ' ' MET . 75.5 mm-40 -64.87 -34.96 79.63 Favored 'General case' 0 CA--C 1.517 -0.293 0 CA-C-O 121.674 0.75 . . . . 2.37 109.85 179.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.734 HG13 ' O ' ' A' ' 103' ' ' THR . 8.9 mt -71.45 -45.49 68.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 CA-C-N 114.604 -1.18 . . . . 0.15 110.879 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.823 HD12 HD11 ' A' ' 48' ' ' LEU . 10.1 mt -63.09 -40.48 89.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 116.135 -0.484 . . . . 0.19 111.331 -179.41 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 36.0 t -58.18 -26.5 62.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.196 -0.456 . . . . 1.14 111.068 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.0 mtt180 -63.41 -49.11 75.05 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.062 0.458 . . . . 1.64 109.883 175.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.426 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 34.2 m-85 -79.75 -12.16 59.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.619 -0.718 . . . . 0.65 110.013 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -74.83 -41.17 60.42 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.102 -0.954 . . . . 0.76 108.819 174.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -77.85 -39.67 42.73 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-N 115.465 -0.788 . . . . 2.27 110.318 175.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -95.66 42.27 1.09 Allowed 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.182 -0.917 . . . . 1.2 110.981 -176.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 C--O 1.251 1.163 0 CA-C-N 115.918 -0.583 . . . . 2.72 110.399 -177.527 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.806 0 N-CA-C 111.909 -0.477 . . . . 19.89 111.909 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 19.5 t -74.0 136.33 76.5 Favored Pre-proline 0 C--N 1.327 -0.409 0 N-CA-C 110.143 -0.317 . . . . 18.33 110.143 -179.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -77.43 56.79 5.67 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.839 2.359 . . . . 17.39 112.504 -179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -101.75 58.85 0.62 Allowed Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 120.93 -0.652 . . . . 16.36 112.09 -179.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 30.2 p90 -97.35 118.81 64.07 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-O 121.053 0.454 . . . . 16.0 110.566 179.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -91.17 16.83 1.5 Allowed 'Trans proline' 0 N--CA 1.458 -0.593 0 C-N-CA 122.921 2.414 . . . . 13.15 112.267 178.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -77.92 100.17 6.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.825 -0.625 . . . . 12.36 110.168 -178.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 141.73 -112.18 0.74 Allowed Glycine 0 N--CA 1.446 -0.672 0 CA-C-N 115.702 -0.681 . . . . 9.63 111.424 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.516 ' HG ' ' HA3' ' B' ' 530' ' ' GLY . 0.1 OUTLIER -149.17 137.52 20.87 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.601 -0.518 . . . . 8.34 109.601 177.339 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . 0.406 ' H ' HD13 ' B' ' 527' ' ' LEU . 5.2 tt -111.3 108.6 18.27 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 108.878 -0.786 . . . . 10.41 108.878 172.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 7.6 t 71.46 48.26 0.34 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 114.991 -1.004 . . . . 7.62 109.103 -177.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . 0.516 ' HA3' ' HG ' ' B' ' 527' ' ' LEU . . . -129.62 -104.6 1.11 Allowed Glycine 0 N--CA 1.436 -1.359 0 CA-C-N 114.96 -1.018 . . . . 5.19 111.309 -179.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -140.6 9.91 2.23 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.88 0.371 . . . . 5.5 110.511 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . 0.407 ' HB2' ' HB2' ' B' ' 527' ' ' LEU . 20.6 mt-10 -123.03 15.25 9.93 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-O 121.651 0.738 . . . . 5.68 110.96 -176.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -83.65 -61.97 1.7 Allowed 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.9 -1.045 . . . . 3.22 111.935 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 36.3 p90 -92.77 -34.62 13.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.2 0.524 . . . . 4.27 110.985 -175.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . 0.469 ' O ' ' HB2' ' B' ' 539' ' ' ASP . 0.5 OUTLIER -75.78 -6.08 48.93 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.33 -0.85 . . . . 1.25 112.047 -173.873 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 49.6 m -88.51 -37.66 15.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.083 0.468 . . . . 2.08 110.29 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 46.0 mm -78.49 -33.9 17.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.378 0.609 . . . . 1.29 109.359 174.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -80.84 8.5 8.08 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 121.747 0.784 . . . . 0.76 110.262 173.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' B' ' 535' ' ' SER . 37.7 t70 -92.49 -43.32 9.24 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.082 -1.081 . . . . 1.23 108.082 170.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 61.3 mmm -54.49 -37.43 65.27 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.454 -1.248 . . . . 2.29 109.407 168.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . 0.443 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 36.9 t70 -53.26 -57.17 11.45 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 114.799 -1.091 . . . . 1.18 110.793 174.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.519 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.3 OUTLIER -65.62 -39.35 91.4 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.037 -0.983 . . . . 0.56 111.622 -172.412 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 33.5 t -60.24 -38.16 82.57 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.264 -0.426 . . . . 1.58 110.788 -178.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -72.68 -31.69 65.23 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.098 0.475 . . . . 0.84 110.904 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 94.4 mt -68.95 -44.44 73.02 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.716 -0.675 . . . . 1.08 111.563 -178.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 44.7 mt -70.69 -26.3 63.36 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.597 0.713 . . . . 0.97 109.462 176.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 8.4 t -70.37 -13.91 62.35 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.012 -0.995 . . . . 1.42 110.303 176.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -72.51 -20.48 61.35 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.468 0.652 . . . . 2.67 110.107 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 67.8 mt -100.18 -49.67 11.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 115.091 -0.959 . . . . 5.23 109.791 177.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 32.8 m -138.07 107.38 6.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.535 -0.757 . . . . 6.4 110.234 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 44.3 m . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.403 -0.808 . . . . 7.59 110.127 178.028 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo . . . . . 0 N--CA 1.479 0.638 0 N-CA-C 110.556 -0.594 . . . . 1.89 110.556 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.8 p -77.84 105.02 8.75 Favored 'General case' 0 N--CA 1.442 -0.856 0 CA-C-O 121.096 0.474 . . . . 2.05 109.933 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.491 ' HB3' ' HB ' ' A' ' 18' ' ' ILE . 75.6 m80 -83.51 6.71 19.44 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.722 -0.672 . . . . 0.75 110.448 179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.8 t -152.17 155.02 36.99 Favored 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 119.891 -0.724 . . . . 1.09 112.626 -168.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.565 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . -174.44 -164.31 29.15 Favored Glycine 0 N--CA 1.437 -1.245 0 CA-C-N 114.341 -1.3 . . . . 0.16 110.554 179.032 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.98 135.05 39.54 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 117.558 0.679 . . . . 0.16 110.906 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.474 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -148.76 153.26 37.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.389 -0.369 . . . . 0.11 111.647 -178.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.766 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.9 mt -112.25 128.29 68.96 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.426 0 CA-C-O 120.686 0.279 . . . . 0.33 110.461 177.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -126.97 133.53 50.56 Favored 'General case' 0 C--N 1.311 -1.105 0 N-CA-C 108.897 -0.779 . . . . 0.36 108.897 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 58.85 27.77 16.58 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 122.758 0.423 . . . . 0.8 110.857 -178.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt 70.5 0.06 3.1 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.218 0.607 . . . . 2.11 112.555 179.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.3 p -92.7 122.46 44.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 108.545 -0.909 . . . . 0.22 108.545 167.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 62.9 p -81.71 145.98 30.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.224 -0.444 . . . . 1.07 111.072 -173.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.451 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -162.68 -154.92 7.8 Favored Glycine 0 N--CA 1.439 -1.103 0 C-N-CA 120.375 -0.917 . . . . 0.11 113.461 -177.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 21.9 mm -126.71 130.5 71.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 109.334 -0.617 . . . . 0.13 109.334 -177.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.575 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -100.8 137.07 29.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 110.101 -0.333 . . . . 0.13 110.101 -175.857 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.83 129.8 28.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.701 0.286 . . . . 0.1 111.573 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.491 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 41.3 mt -85.5 139.02 18.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 CA-C-O 121.237 0.542 . . . . 0.27 109.81 174.882 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.438 ' O ' ' HA ' ' A' ' 25' ' ' ALA . 17.4 t30 -110.33 103.26 11.9 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 114.973 -1.012 . . . . 1.24 111.301 -174.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 31.1 mt-10 -114.61 169.76 8.82 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.863 -0.791 . . . . 1.2 108.863 174.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.457 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 38.0 t70 79.49 -5.59 1.91 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 122.446 1.117 . . . . 0.58 109.776 -176.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.644 HG23 ' O ' ' A' ' 23' ' ' SER . 22.8 m -103.23 -172.73 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.312 -1.05 0 CA-C-N 113.767 -1.561 . . . . 0.25 109.406 178.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.644 ' O ' HG23 ' A' ' 22' ' ' VAL . 59.3 p -72.41 167.92 28.31 Favored Pre-proline 0 C--N 1.321 -0.648 0 N-CA-C 105.199 -2.149 . . . . 1.13 105.199 175.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -41.66 127.04 3.35 Favored 'Trans proline' 0 C--N 1.355 0.892 0 CA-C-N 121.317 1.506 . . . . 0.16 112.729 -143.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.438 ' HA ' ' O ' ' A' ' 19' ' ' ASN . . . -43.38 136.8 2.98 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 113.841 -1.527 . . . . 0.1 112.895 -168.705 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.68 169.07 12.33 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 114.092 -1.413 . . . . 0.32 111.679 -169.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.668 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -119.57 105.38 11.16 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 107.807 -1.183 . . . . 0.09 107.807 174.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 20.7 m -104.58 106.89 17.56 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-O 121.155 0.502 . . . . 0.17 111.245 -176.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.41 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 79.9 t90 -84.63 128.61 34.69 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.965 -0.754 . . . . 0.14 108.965 172.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.474 ' HG2' HG23 ' A' ' 37' ' ' VAL . 96.1 mtt180 -120.48 158.11 27.94 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.455 -0.943 . . . . 1.91 108.455 172.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 p -70.18 176.09 4.12 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 109.275 -0.639 . . . . 0.6 109.275 178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.451 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 4.2 p -57.32 -36.25 70.88 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.391 -0.524 . . . . 0.26 111.004 -179.022 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -91.82 -30.92 15.93 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.569 0.699 . . . . 2.12 109.759 172.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.421 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 99.5 15.5 32.0 Favored Glycine 0 N--CA 1.447 -0.583 0 CA-C-N 115.152 -0.931 . . . . 0.23 112.769 175.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -64.92 -42.06 95.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.334 -0.617 . . . . 1.73 109.334 175.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -91.27 139.41 30.76 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.815 -0.809 . . . . 1.3 108.815 173.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.474 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.9 p -149.61 137.72 14.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-O 120.79 0.328 . . . . 0.17 110.967 -179.071 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -144.51 129.04 18.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.634 -0.257 . . . . 0.41 110.351 179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 53.3 m -112.52 143.59 43.42 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.216 0.451 . . . . 0.15 112.216 -174.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.668 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -113.6 129.89 68.62 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.722 0 N-CA-C 107.923 -1.14 . . . . 0.12 107.923 167.847 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 67.2 t -92.32 121.04 42.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 O-C-N 121.024 -1.047 . . . . 0.11 108.914 173.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.619 HD11 HD22 ' A' ' 104' ' ' LEU . 2.8 mm? -68.91 -18.38 64.1 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 113.011 0.745 . . . . 0.08 113.011 -169.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.4 p -69.02 -16.76 63.79 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.574 0.702 . . . . 0.87 109.382 175.184 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.415 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 4.7 p -109.06 16.62 22.43 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 114.977 -1.011 . . . . 0.15 110.088 -178.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.489 HG21 HD13 ' A' ' 62' ' ' LEU . 31.2 mm -112.25 138.38 41.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.759 -0.46 . . . . 0.12 109.759 178.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -102.07 -40.22 6.94 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.013 -0.54 . . . . 0.52 110.657 -176.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.459 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 12.4 mtmm -144.96 174.46 11.0 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.872 0.367 . . . . 1.41 111.26 179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.627 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -151.34 133.63 15.32 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 108.632 -0.877 . . . . 0.73 108.632 177.079 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.718 ' HG3' HD11 ' A' ' 63' ' ' ILE . 9.2 mt-30 -130.01 127.2 39.5 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 110.285 -0.265 . . . . 1.94 110.285 -176.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.407 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -118.06 141.47 48.44 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 121.914 -0.492 . . . . 0.22 111.039 178.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.444 HG21 ' HB3' ' A' ' 57' ' ' LYS . 53.0 p -62.29 121.24 65.24 Favored Pre-proline 0 C--N 1.332 -0.175 0 CA-C-N 115.912 -0.585 . . . . 0.26 110.633 -178.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.435 ' O ' ' HB2' ' A' ' 55' ' ' SER . 24.0 Cg_exo -53.96 163.58 3.04 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.66 2.24 . . . . 0.38 112.465 178.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -64.92 -34.73 79.1 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.146 -0.479 . . . . 0.66 110.598 -179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 6.0 m -76.11 -13.73 60.2 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.569 -0.741 . . . . 1.5 111.035 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.435 ' HB2' ' O ' ' A' ' 52' ' ' PRO . 46.1 m -75.1 135.3 41.18 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 121.697 0.761 . . . . 0.85 111.391 179.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -59.46 -26.77 65.51 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.009 -1.45 . . . . 1.77 110.756 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.444 ' HB3' HG21 ' A' ' 51' ' ' THR . 37.0 mmtt -82.74 146.74 28.84 Favored 'General case' 0 N--CA 1.431 -1.394 0 CA-C-N 114.399 -1.273 . . . . 1.63 111.493 -177.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.569 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.4 OUTLIER -123.07 96.63 5.09 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.032 -0.986 . . . . 1.11 108.564 170.021 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.569 ' HG3' ' O ' ' A' ' 58' ' ' MET . 0.0 OUTLIER -156.31 152.31 27.5 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-O 121.585 0.707 . . . . 0.22 112.069 -173.543 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.62 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -129.83 118.89 22.47 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.553 -1.203 . . . . 0.1 108.143 177.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.488 ' HG3' ' CE2' ' B' ' 542' ' ' PHE . 15.0 mtm180 -101.83 133.47 46.54 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.229 0.538 . . . . 2.99 110.886 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.944 HD21 HD13 ' A' ' 104' ' ' LEU . 1.3 mm? -111.84 107.26 16.24 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 115.099 -0.955 . . . . 0.13 109.205 176.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.718 HD11 ' HG3' ' A' ' 49' ' ' GLN . 1.4 mp -85.31 97.81 5.88 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 109.368 -0.604 . . . . 0.29 109.368 -172.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.463 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -76.31 134.48 15.72 Favored Glycine 0 N--CA 1.446 -0.686 0 CA-C-N 115.941 -0.572 . . . . 0.54 112.46 -176.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.437 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 96.1 mttt -56.65 149.23 18.11 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 123.162 0.585 . . . . 0.55 112.188 -176.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.763 HG13 ' HA ' ' A' ' 84' ' ' PRO . 1.4 m -118.45 146.25 23.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-N 116.054 -0.521 . . . . 1.73 110.176 168.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.75 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 18.7 t70 -79.04 81.76 5.28 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 109.02 -0.733 . . . . 3.23 109.02 176.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -67.11 -2.3 5.41 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.013 0.745 . . . . 2.39 113.013 -169.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -71.16 -14.16 62.18 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.155 0.503 . . . . 2.96 110.059 170.105 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.75 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.1 ptpt -82.3 36.22 0.46 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.759 -0.655 . . . . 2.49 110.742 175.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.508 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 31.5 mmtm -44.97 116.1 1.02 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.624 -0.51 . . . . 3.4 109.624 -178.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.618 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 60.4 ttt180 -96.87 164.49 12.53 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 108.755 -0.831 . . . . 3.8 108.755 -173.065 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 57.3 mttp -127.69 141.88 51.48 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.987 0.422 . . . . 4.29 110.023 171.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -82.69 -171.07 3.3 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.466 -0.788 . . . . 4.41 110.451 -176.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -61.27 -31.14 70.96 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 111.606 0.225 . . . . 5.34 111.606 -178.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.478 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 28.1 mt-10 -85.14 -18.81 33.04 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 121.079 -0.248 . . . . 5.38 111.332 -179.11 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 99.84 25.67 8.97 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.403 -0.903 . . . . 4.37 112.952 177.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.537 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 31.1 m-80 -90.47 144.69 25.56 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.233 -0.654 . . . . 4.51 109.233 176.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -69.86 91.45 0.65 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.883 0.373 . . . . 4.28 110.168 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.618 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.7 m -102.68 97.38 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 CA-C-O 122.014 0.911 . . . . 3.1 108.99 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.508 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 2.2 p -83.04 130.82 55.85 Favored Pre-proline 0 C--N 1.31 -1.15 0 CA-C-N 115.313 -0.858 . . . . 2.5 109.784 -178.221 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 47.8 Cg_exo -60.07 132.81 46.5 Favored 'Trans proline' 0 CA--C 1.512 -0.599 0 C-N-CA 122.77 2.313 . . . . 1.87 111.993 -176.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -82.98 154.38 67.42 Favored Pre-proline 0 C--N 1.315 -0.906 0 CA-C-N 115.228 -0.897 . . . . 2.74 109.252 179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.763 ' HA ' HG13 ' A' ' 66' ' ' VAL . 21.3 Cg_exo -60.12 149.49 84.55 Favored 'Trans proline' 0 N--CA 1.463 -0.282 0 C-N-CA 122.795 2.33 . . . . 0.84 112.153 -174.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -89.63 115.63 27.17 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.359 0.6 . . . . 1.57 110.256 -174.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.495 ' HG2' HG13 ' A' ' 63' ' ' ILE . 47.5 mtm180 -98.85 122.26 41.87 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-N 115.768 -0.651 . . . . 2.52 111.623 -170.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.484 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 59.3 m-70 -97.02 111.42 23.65 Favored 'General case' 0 C--O 1.217 -0.619 0 CA-C-N 115.092 -0.958 . . . . 0.72 109.361 -178.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.415 ' HG3' ' HG2' ' A' ' 61' ' ' ARG . 33.5 ttm -107.75 131.95 53.9 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 119.857 -0.737 . . . . 0.27 111.643 -176.671 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.531 ' O ' ' HA ' ' A' ' 59' ' ' MET . 8.7 m-85 -121.19 133.06 55.17 Favored 'General case' 0 C--O 1.215 -0.714 0 CA-C-N 115.5 -0.773 . . . . 0.27 109.869 177.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.766 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -80.05 159.23 26.24 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 109.231 -0.655 . . . . 1.26 109.231 176.501 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.566 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 18.7 m-85 -136.85 173.28 11.87 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.377 0.608 . . . . 0.32 112.021 -177.392 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -118.7 -21.46 7.87 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.043 -0.98 . . . . 2.38 110.208 178.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.482 ' HB2' HG23 ' A' ' 96' ' ' VAL . 53.4 m-80 -139.49 125.95 20.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.215 0.531 . . . . 1.1 110.74 -177.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.588 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.7 mmm180 -57.89 -30.88 66.23 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.192 -0.913 . . . . 3.09 111.997 177.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 25.7 m -64.27 -29.22 70.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.004 0.43 . . . . 0.35 110.554 -178.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.732 ' HA ' ' ND2' ' A' ' 99' ' ' ASN . 5.2 t -85.15 -46.68 17.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 116.233 -0.44 . . . . 0.23 110.983 -177.347 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.62 ' HA ' HD12 ' A' ' 60' ' ' LEU . 10.2 ptp -61.72 -25.56 67.5 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.171 -0.612 . . . . 0.17 109.668 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 102' ' ' MET . 20.8 t70 -77.39 -38.59 49.57 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.137 -0.483 . . . . 0.34 110.642 172.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.732 ' ND2' ' HA ' ' A' ' 96' ' ' VAL . 11.2 p30 -77.12 -33.58 56.79 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 111.705 0.261 . . . . 1.36 111.705 -175.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.651 HG22 HD11 ' A' ' 104' ' ' LEU . 39.2 mm -70.52 -56.02 12.4 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.529 0 N-CA-C 108.388 -0.967 . . . . 0.12 108.388 174.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.782 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.5 ttpt -48.89 -48.51 42.27 Favored 'General case' 0 C--O 1.218 -0.569 0 O-C-N 123.976 0.797 . . . . 0.79 109.752 176.648 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.764 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 40.7 ttp -48.44 -59.62 3.33 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.49 -0.777 . . . . 0.28 110.757 177.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.724 ' O ' HG13 ' A' ' 107' ' ' ILE . 60.0 m -57.77 -52.89 63.59 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 123.483 0.489 . . . . 0.18 110.71 -179.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.944 HD13 HD21 ' A' ' 62' ' ' LEU . 24.7 mt -47.28 -55.42 8.74 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.486 0.66 . . . . 0.09 110.527 175.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.547 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.3 mt-30 -51.69 -44.21 63.04 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 114.615 -1.175 . . . . 1.2 112.074 177.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.764 ' HG3' ' O ' ' A' ' 102' ' ' MET . 81.0 mt-30 -64.36 -35.47 80.97 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-O 121.725 0.774 . . . . 2.37 109.367 -179.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.724 HG13 ' O ' ' A' ' 103' ' ' THR . 7.6 mt -75.95 -43.35 39.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 114.257 -1.338 . . . . 0.15 111.559 -176.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.585 HD12 HD11 ' A' ' 48' ' ' LEU . 7.2 mt -62.19 -43.15 97.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.25 0.463 . . . . 0.19 112.25 -175.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.455 ' HA ' ' CB ' ' A' ' 112' ' ' LYS . 24.2 t -62.45 -20.17 64.26 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.69 0.281 . . . . 1.14 111.279 -176.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 85.7 mtt180 -65.21 -44.21 89.06 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.518 0.675 . . . . 1.64 109.307 173.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -87.54 -11.78 47.76 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.088 -0.96 . . . . 0.65 110.303 -179.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.455 ' CB ' ' HA ' ' A' ' 109' ' ' SER . 1.8 tpmt? -70.06 -37.91 75.63 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.795 -0.817 . . . . 0.76 108.795 173.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -67.3 -39.16 85.92 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 115.121 -0.945 . . . . 2.27 109.951 172.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -96.82 42.0 1.1 Allowed 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 114.859 -1.064 . . . . 1.2 110.684 -178.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 21.6 t70 . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.583 -0.723 . . . . 2.72 109.916 -179.119 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.774 0 N-CA-C 112.116 -0.394 . . . . 19.89 112.116 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 50.8 m -150.64 75.09 8.61 Favored Pre-proline 0 C--N 1.322 -0.587 0 N-CA-C 109.88 -0.415 . . . . 18.33 109.88 178.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -69.14 -21.16 36.79 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 123.278 2.652 . . . . 17.39 112.523 -176.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . 0.445 ' HA2' ' HA ' ' A' ' 80' ' ' VAL . . . 81.79 -124.74 6.59 Favored Glycine 0 N--CA 1.442 -0.942 0 N-CA-C 111.154 -0.778 . . . . 16.36 111.154 -176.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 81.3 m-85 64.75 113.32 0.03 OUTLIER Pre-proline 0 N--CA 1.466 0.344 0 CA-C-O 121.235 0.54 . . . . 16.0 112.238 177.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -57.13 150.49 56.68 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.499 2.133 . . . . 13.15 111.253 173.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -78.05 47.14 0.63 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.99 0.367 . . . . 12.36 111.99 -174.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 63.94 -89.71 0.08 OUTLIER Glycine 0 CA--C 1.518 0.264 0 N-CA-C 114.11 0.404 . . . . 9.63 114.11 174.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -80.12 26.45 0.35 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.446 0.535 . . . . 8.34 112.446 -171.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 26.0 mt -66.05 -11.0 45.38 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 121.535 0.683 . . . . 10.41 110.17 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 9.3 m -113.11 -37.26 4.81 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 114.757 -1.111 . . . . 7.62 108.712 174.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 108.95 -33.24 6.28 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.479 -0.782 . . . . 5.19 113.289 174.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -100.86 -4.17 28.35 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.973 0.892 . . . . 5.5 109.124 -176.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -96.81 -0.56 47.78 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.265 -1.334 . . . . 5.68 110.463 -178.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -73.03 -38.19 66.64 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.402 -1.272 . . . . 3.22 110.907 -176.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -60.8 -47.62 85.52 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.651 -0.704 . . . . 4.27 110.781 -177.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 11.4 p -77.41 -12.68 59.98 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-N 115.198 -0.91 . . . . 1.25 111.357 -177.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 69.2 m -80.69 -39.34 27.35 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.983 0.421 . . . . 2.08 110.134 174.029 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . 0.438 HD13 ' HA ' ' B' ' 537' ' ' ILE . 13.3 mm -75.15 -42.82 44.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 116.191 -0.459 . . . . 1.29 110.511 175.328 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -75.43 4.06 8.06 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.454 0.645 . . . . 0.76 110.923 178.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -80.3 -37.43 32.71 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.804 -0.813 . . . . 1.23 108.804 170.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 42.1 mtm -63.8 -32.45 73.95 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.017 -0.992 . . . . 2.29 109.349 173.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . 0.589 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 3.3 m-20 -65.19 -56.39 13.1 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.464 -0.789 . . . . 1.18 110.889 173.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.488 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.5 OUTLIER -65.74 -49.01 69.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.566 -0.743 . . . . 0.56 112.454 -171.175 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 31.5 t -60.83 -37.92 83.66 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.843 0.354 . . . . 1.58 110.546 -176.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -68.9 -23.92 64.25 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.083 -0.508 . . . . 0.84 111.216 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 95.4 mt -80.01 -42.25 24.22 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.355 -0.384 . . . . 1.08 111.461 -178.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . 0.444 HD11 ' HB3' ' A' ' 49' ' ' GLN . 61.0 mt -70.09 -40.77 74.77 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.49 0.662 . . . . 0.97 110.214 179.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 39.6 m -86.21 25.61 1.15 Allowed 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.141 -0.936 . . . . 1.42 112.172 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' B' ' 545' ' ' LEU . 10.2 pt20 -128.4 24.05 5.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.984 0.421 . . . . 2.67 110.177 173.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 3.5 tt -69.87 111.79 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.182 0 CA-C-O 121.414 0.626 . . . . 5.23 110.53 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 5.2 p -94.43 66.51 3.34 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.545 -0.752 . . . . 6.4 110.03 178.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 21.7 t . . . . . 0 C--O 1.247 0.964 0 CA-C-N 115.272 -0.876 . . . . 7.59 108.875 -177.846 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo . . . . . 0 N--CA 1.476 0.442 0 N-CA-C 110.778 -0.508 . . . . 1.89 110.778 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.0 m -73.87 -18.4 60.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.21 -0.45 . . . . 2.05 111.193 -178.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.445 ' HB3' ' HB ' ' A' ' 18' ' ' ILE . 75.9 m80 68.74 2.48 3.49 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 112.498 0.555 . . . . 0.75 112.498 175.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 47.2 t -153.03 157.74 40.94 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.779 0.8 . . . . 1.09 112.717 -169.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.485 ' HA3' ' CG1' ' A' ' 96' ' ' VAL . . . -176.08 -170.04 38.33 Favored Glycine 0 N--CA 1.441 -1.023 0 CA-C-N 114.125 -1.398 . . . . 0.16 109.83 178.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -93.19 135.17 34.64 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 117.71 0.755 . . . . 0.16 110.375 179.551 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.44 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -145.85 146.04 30.98 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.275 -0.42 . . . . 0.11 111.367 -177.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.455 HG12 ' HA ' ' A' ' 13' ' ' SER . 85.1 mt -107.37 120.65 59.06 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.615 0 CA-C-N 116.304 -0.407 . . . . 0.33 110.287 177.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -123.36 137.47 54.82 Favored 'General case' 0 C--N 1.311 -1.085 0 N-CA-C 108.801 -0.814 . . . . 0.36 108.801 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 57.27 25.66 11.39 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 122.659 0.384 . . . . 0.8 110.736 -176.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 56.8 mtmt 69.14 5.63 5.2 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 112.774 0.657 . . . . 2.11 112.774 179.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -97.48 129.9 46.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 N-CA-C 108.884 -0.784 . . . . 0.22 108.884 166.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.455 ' HA ' HG12 ' A' ' 8' ' ' ILE . 15.0 m -78.53 146.07 34.52 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.02 0.438 . . . . 1.07 110.861 -175.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.406 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -164.19 -160.18 11.69 Favored Glycine 0 N--CA 1.437 -1.273 0 C-N-CA 120.133 -1.032 . . . . 0.11 113.052 -178.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.6 mm -126.05 133.11 69.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.148 -0.686 . . . . 0.13 109.148 -178.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.524 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -102.75 134.91 42.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 109.886 -0.413 . . . . 0.13 109.886 -176.862 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.95 130.61 31.81 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.568 0.223 . . . . 0.1 111.149 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.445 ' HB ' ' HB3' ' A' ' 3' ' ' HIS . 47.3 mt -86.6 139.4 17.41 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 121.311 0.577 . . . . 0.27 110.397 175.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -110.38 105.88 15.04 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 114.933 -1.03 . . . . 1.24 111.185 -176.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -116.9 170.41 8.64 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.146 -0.687 . . . . 1.2 109.146 174.692 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 20.6 t70 77.78 -1.49 2.62 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 122.505 1.145 . . . . 0.58 109.399 -179.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.636 HG23 ' O ' ' A' ' 23' ' ' SER . 31.6 m -103.48 -171.86 0.33 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.922 0 CA-C-N 113.559 -1.655 . . . . 0.25 109.383 177.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.636 ' O ' HG23 ' A' ' 22' ' ' VAL . 70.7 p -72.67 168.65 22.2 Favored Pre-proline 0 C--N 1.32 -0.681 0 N-CA-C 105.202 -2.148 . . . . 1.13 105.202 174.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.4 ' O ' HG13 ' A' ' 41' ' ' VAL . 72.9 Cg_exo -41.53 129.0 3.59 Favored 'Trans proline' 0 C--N 1.357 0.994 0 CA-C-N 121.501 1.572 . . . . 0.16 112.368 -145.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.469 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -52.56 142.17 18.64 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 114.164 -1.38 . . . . 0.1 112.381 -162.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -124.76 168.68 12.87 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 114.64 -1.163 . . . . 0.32 112.019 -170.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.754 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -119.79 108.97 15.04 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.798 -1.186 . . . . 0.09 107.798 175.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.5 m -103.98 107.08 17.81 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 120.761 0.315 . . . . 0.17 111.1 -176.197 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.423 ' O ' ' HA ' ' A' ' 37' ' ' VAL . 86.9 t90 -86.85 129.04 35.04 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 109.122 -0.696 . . . . 0.14 109.122 171.365 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.498 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 92.0 mtt180 -123.32 160.55 26.48 Favored 'General case' 0 C--N 1.31 -1.136 0 N-CA-C 109.059 -0.719 . . . . 1.91 109.059 172.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.4 p -70.65 175.72 4.7 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.204 -0.665 . . . . 0.6 109.204 177.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.406 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.0 p -59.32 -35.88 74.62 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.221 -0.592 . . . . 0.26 111.104 -179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -88.39 -32.56 18.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.579 0.704 . . . . 2.12 109.396 171.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.498 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 98.56 14.79 36.69 Favored Glycine 0 N--CA 1.445 -0.736 0 CA-C-N 114.957 -1.019 . . . . 0.23 113.339 173.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -67.47 -40.96 85.31 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.186 0.517 . . . . 1.73 109.776 174.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -86.2 135.58 33.52 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.577 -0.897 . . . . 1.3 108.577 174.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 29' ' ' TRP . 12.0 p -149.46 140.26 16.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 C-N-CA 120.846 -0.342 . . . . 0.17 111.461 -177.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -144.32 125.4 14.51 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.832 -0.432 . . . . 0.41 109.832 175.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.466 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 41.1 m -109.26 137.63 46.84 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 111.752 0.279 . . . . 0.15 111.752 -175.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.754 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -107.98 128.84 63.02 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 N-CA-C 108.329 -0.989 . . . . 0.12 108.329 169.583 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.409 ' O ' HG12 ' A' ' 45' ' ' ILE . 79.5 t -92.84 120.02 41.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 O-C-N 121.234 -0.916 . . . . 0.11 108.781 173.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.524 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -69.08 -19.59 64.07 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 113.077 0.769 . . . . 0.08 113.077 -169.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.6 p -69.46 -14.87 63.12 Favored 'General case' 0 C--N 1.322 -0.619 0 C-N-CA 119.821 -0.752 . . . . 0.87 109.553 175.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 4.6 p -109.93 11.34 24.16 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.477 -0.783 . . . . 0.15 109.921 -179.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.597 HG21 ' CD1' ' A' ' 62' ' ' LEU . 20.5 mm -111.84 139.88 34.06 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.718 -0.674 . . . . 0.12 109.263 178.028 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -108.44 -40.73 5.04 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 116.396 -0.365 . . . . 0.52 110.914 -176.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.535 ' HB2' ' HB ' ' A' ' 63' ' ' ILE . 34.6 mtpt -132.61 167.83 19.34 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-O 121.709 0.766 . . . . 1.41 111.402 -178.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.594 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -150.77 132.69 15.12 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.432 -1.258 . . . . 0.73 107.862 174.811 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.49 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -133.06 114.76 14.3 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 110.329 -0.249 . . . . 1.94 110.329 -172.413 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.448 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -110.09 145.16 37.6 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.827 0.346 . . . . 0.22 110.981 -178.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 57' ' ' LYS . 76.4 p -67.54 118.42 56.91 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 115.765 -0.652 . . . . 0.26 110.781 -177.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.542 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 9.6 Cg_exo -59.82 163.16 14.12 Favored 'Trans proline' 0 N--CA 1.46 -0.459 0 C-N-CA 122.445 2.097 . . . . 0.38 111.737 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -72.96 -8.05 53.89 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.199 -0.455 . . . . 0.66 111.032 -179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 8.4 t -94.22 -4.82 48.27 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.358 0.599 . . . . 1.5 109.676 174.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.542 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 33.9 m -87.65 143.23 27.29 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.601 -0.727 . . . . 0.85 111.175 178.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -69.24 -12.07 61.35 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.031 -0.986 . . . . 1.77 110.615 175.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.419 ' HD3' HD11 ' B' ' 545' ' ' LEU . 1.4 mptp? -99.86 154.06 18.65 Favored 'General case' 0 N--CA 1.432 -1.349 0 CA-C-N 114.894 -1.048 . . . . 1.63 111.391 -174.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.415 ' HE3' ' HB3' ' A' ' 58' ' ' MET . 80.5 mmm -127.67 98.25 5.13 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.109 -0.7 . . . . 1.11 109.109 168.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.467 ' HA ' ' HA ' ' A' ' 90' ' ' SER . 0.2 OUTLIER -156.36 155.59 32.45 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.869 -0.605 . . . . 0.22 111.644 -173.205 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.577 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.5 tt -130.81 119.15 21.84 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.363 -0.977 . . . . 0.1 108.363 175.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.544 ' NH1' ' HD2' ' A' ' 86' ' ' ARG . 52.2 mtm180 -101.24 146.32 27.69 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.877 0.37 . . . . 2.99 111.288 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.899 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -128.15 106.75 9.27 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.399 -0.819 . . . . 0.13 109.565 179.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.559 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.6 mp -95.71 113.97 31.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 122.509 0.323 . . . . 0.29 110.478 -172.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.661 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -65.25 169.22 28.57 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 121.26 -0.495 . . . . 0.54 113.194 178.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -86.31 150.9 24.02 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.871 0.367 . . . . 0.55 110.926 177.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.695 HG22 ' HG3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -106.29 118.86 54.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-N 115.952 -0.567 . . . . 1.73 111.617 -174.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.763 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.1 t70 -92.35 77.4 5.15 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 108.119 -1.067 . . . . 3.23 108.119 170.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.433 ' HG3' ' HB ' ' A' ' 66' ' ' VAL . 43.3 mt-10 -73.16 -2.24 20.79 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 111.847 0.314 . . . . 2.39 111.847 -170.037 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 4.8 p -71.53 -6.3 39.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.36 0.6 . . . . 2.96 110.166 171.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.763 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 17.8 ptmt -91.35 36.17 0.93 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.677 -0.692 . . . . 2.49 110.402 175.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.578 ' HD2' ' HB ' ' A' ' 81' ' ' VAL . 13.1 mmmt -44.33 113.93 0.61 Allowed 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 109.132 -0.692 . . . . 3.4 109.132 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.602 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.0 ttt180 -102.4 167.02 10.22 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 115.621 -0.718 . . . . 3.8 109.303 -168.246 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.501 ' N ' ' HG2' ' A' ' 72' ' ' ARG . 56.5 mttp -132.6 128.46 37.2 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.642 -0.503 . . . . 4.29 109.642 171.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -83.3 -166.06 1.26 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.026 -0.534 . . . . 4.41 110.021 -178.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -58.79 -26.16 63.81 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.913 0.387 . . . . 5.34 111.554 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -87.27 -7.44 57.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.937 -0.574 . . . . 5.38 111.782 -174.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 79.57 3.65 88.97 Favored Glycine 0 C--N 1.332 0.306 0 C-N-CA 120.736 -0.745 . . . . 4.37 112.347 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.425 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 93.9 m-20 -71.19 139.64 50.23 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.438 -0.579 . . . . 4.51 109.438 175.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.504 ' CD ' ' HE3' ' A' ' 71' ' ' LYS . 34.3 tt0 -72.1 90.39 1.19 Allowed 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.529 -0.545 . . . . 4.28 109.529 179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.602 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 31.3 m -92.68 99.51 9.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.168 0 CA-C-O 121.785 0.803 . . . . 3.1 109.208 179.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.578 ' HB ' ' HD2' ' A' ' 71' ' ' LYS . 0.8 OUTLIER -80.03 108.38 9.14 Favored Pre-proline 0 C--N 1.309 -1.165 0 N-CA-C 108.813 -0.81 . . . . 2.5 108.813 175.951 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.491 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 54.0 Cg_exo -58.23 138.8 87.83 Favored 'Trans proline' 0 CA--C 1.513 -0.527 0 C-N-CA 123.363 2.709 . . . . 1.87 112.953 -170.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.442 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 21.9 mtpp -82.61 164.73 45.82 Favored Pre-proline 0 C--N 1.318 -0.762 0 CA-C-N 114.972 -1.013 . . . . 2.74 109.66 179.572 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.695 ' HG3' HG22 ' A' ' 66' ' ' VAL . 17.6 Cg_exo -58.81 155.73 36.46 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 122.104 1.87 . . . . 0.84 112.366 -179.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -85.48 113.97 22.15 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 108.679 -0.86 . . . . 1.57 108.679 174.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.544 ' HD2' ' NH1' ' A' ' 61' ' ' ARG . 29.8 ttp180 -111.5 117.24 32.47 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 114.837 -1.074 . . . . 2.52 110.553 -170.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.534 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 78.3 m-70 -95.85 148.98 22.03 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 113.749 -1.568 . . . . 0.72 108.69 -175.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.426 ' HA ' ' HA ' ' A' ' 61' ' ' ARG . 32.6 ttm -141.34 129.46 22.1 Favored 'General case' 0 C--N 1.32 -0.684 0 C-N-CA 120.396 -0.522 . . . . 0.27 110.838 173.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.44 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 8.7 m-85 -118.19 127.42 53.73 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.611 -0.722 . . . . 0.27 109.565 178.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.467 ' HA ' ' HA ' ' A' ' 59' ' ' MET . 0.5 OUTLIER -80.69 153.55 27.82 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 109.825 -0.435 . . . . 1.26 109.825 177.205 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.457 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 22.1 m-85 -133.58 170.3 15.72 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.247 0.546 . . . . 0.32 111.543 -174.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -117.51 -13.86 10.3 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.245 -0.889 . . . . 2.38 109.927 176.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.526 ' HB2' HG23 ' A' ' 96' ' ' VAL . 57.1 m-80 -141.31 126.17 18.13 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 121.038 0.447 . . . . 1.1 110.432 -177.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.488 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.5 mmm180 -62.33 -34.13 76.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.413 -0.812 . . . . 3.09 111.816 179.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.7 m -63.05 -32.67 74.09 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.404 -0.362 . . . . 0.35 110.793 -177.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.548 ' O ' HG12 ' A' ' 100' ' ' ILE . 11.8 t -71.04 -57.45 7.61 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.362 0 CA-C-N 116.206 -0.452 . . . . 0.23 110.284 179.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.577 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.6 ptp -56.53 -39.07 72.73 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.974 -0.557 . . . . 0.17 111.136 -176.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.433 ' N ' ' HG3' ' A' ' 97' ' ' MET . 16.0 t70 -65.13 -39.44 93.04 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.804 -0.358 . . . . 0.34 110.36 179.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -75.08 -39.9 60.49 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.247 -0.433 . . . . 1.36 111.763 -179.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.548 HG12 ' O ' ' A' ' 96' ' ' VAL . 30.2 mm -63.89 -55.52 21.84 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.361 0 N-CA-C 108.656 -0.868 . . . . 0.12 108.656 176.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.814 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.4 ttpt -51.05 -47.51 61.75 Favored 'General case' 0 C--O 1.218 -0.565 0 O-C-N 123.827 0.704 . . . . 0.79 109.885 176.662 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.688 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 35.2 ttp -50.33 -56.3 11.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.626 -0.715 . . . . 0.28 110.999 177.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.708 ' O ' HG13 ' A' ' 107' ' ' ILE . 40.5 m -58.32 -53.29 59.99 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.482 0.489 . . . . 0.18 110.557 179.618 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.899 HD13 HD21 ' A' ' 62' ' ' LEU . 25.8 mt -47.23 -54.38 10.95 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 115.722 -0.672 . . . . 0.09 110.631 175.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.549 ' HG2' HD13 ' A' ' 48' ' ' LEU . 44.1 mt-30 -51.25 -46.63 62.42 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 114.698 -1.137 . . . . 1.2 112.223 177.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 102' ' ' MET . 18.9 mt-30 -60.04 -40.46 89.49 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-O 122.006 0.908 . . . . 2.37 108.864 -179.533 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.708 HG13 ' O ' ' A' ' 103' ' ' THR . 7.4 mt -69.15 -46.5 77.84 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.86 0 CA-C-N 113.878 -1.51 . . . . 0.15 111.165 -178.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.576 HD12 HD11 ' A' ' 48' ' ' LEU . 6.0 mt -62.24 -42.19 94.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.223 -0.444 . . . . 0.19 111.635 -177.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 32.9 t -56.88 -29.69 63.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.655 0.264 . . . . 1.14 111.022 -178.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -61.1 -42.11 97.92 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.459 0.647 . . . . 1.64 109.905 176.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 36.2 m-85 -92.43 -3.93 54.49 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.217 -0.901 . . . . 0.65 110.22 -178.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.79 -37.1 23.01 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.316 -0.856 . . . . 0.76 108.884 176.629 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -81.28 -12.05 59.19 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.271 -0.877 . . . . 2.27 110.702 174.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -89.71 29.31 1.18 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.888 -0.596 . . . . 1.2 110.773 178.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 28.4 t70 . . . . . 0 C--O 1.246 0.871 0 CA-C-O 118.472 -0.775 . . . . 2.72 110.37 -179.839 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.589 0 N-CA-C 111.877 -0.489 . . . . 19.89 111.877 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 16.4 m 60.13 85.44 0.18 Allowed Pre-proline 0 CA--C 1.533 0.317 0 C-N-CA 122.741 0.416 . . . . 18.33 110.954 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -62.84 113.39 1.97 Allowed 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.673 2.248 . . . . 17.39 112.604 -176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -78.37 -31.6 45.8 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.82 -0.627 . . . . 16.36 111.779 178.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . 0.445 ' HA ' ' HD3' ' B' ' 524' ' ' PRO . 43.8 p90 -140.3 138.65 19.36 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.64 -0.504 . . . . 16.0 109.64 177.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' B' ' 523' ' ' TYR . 33.1 Cg_exo -61.5 108.89 0.66 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.622 2.215 . . . . 13.15 111.967 178.379 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -118.72 -90.51 0.57 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.342 -0.39 . . . . 12.36 110.485 -179.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 61.56 -163.48 22.96 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 121.025 -0.607 . . . . 9.63 112.451 -178.325 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 2.1 pp -87.67 8.4 25.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.715 0.769 . . . . 8.34 110.58 176.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 1.2 tt -80.14 -0.26 35.2 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 106.993 -1.484 . . . . 10.41 106.993 169.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 50.7 m -138.08 173.31 11.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 113.897 -1.501 . . . . 7.62 108.332 178.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 140.87 -36.4 1.76 Allowed Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.11 -1.043 . . . . 5.19 112.071 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . 0.417 ' HA ' ' CE2' ' B' ' 534' ' ' PHE . 23.0 t70 -150.83 -41.22 0.12 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.535 0.684 . . . . 5.5 111.362 -179.362 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -81.32 -7.55 59.59 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 115.268 -0.878 . . . . 5.68 111.745 -175.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -97.13 -9.27 28.27 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.894 -1.048 . . . . 3.22 111.515 -175.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . 0.417 ' CE2' ' HA ' ' B' ' 531' ' ' ASP . 36.9 m-85 -57.75 -48.9 78.33 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-O 121.183 0.516 . . . . 4.27 111.482 -178.118 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 11.2 p -70.26 -27.47 64.46 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.598 -0.728 . . . . 1.25 111.094 -178.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 11.7 m -74.72 -39.49 61.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.162 -0.472 . . . . 2.08 110.723 178.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . 0.442 HD13 ' HA ' ' B' ' 537' ' ' ILE . 18.5 mm -74.8 -28.03 21.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 116.101 -0.5 . . . . 1.29 110.326 175.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . 0.475 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -71.81 -1.17 13.16 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.466 0.65 . . . . 0.76 111.459 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -73.06 -38.52 66.44 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 108.746 -0.835 . . . . 1.23 108.746 170.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 85.7 mtp -65.71 -35.28 80.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.028 -0.987 . . . . 2.29 109.857 175.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . 0.542 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 0.2 OUTLIER -65.27 -49.16 70.62 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.759 -0.655 . . . . 1.18 110.495 177.159 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.475 ' HA ' HD12 ' B' ' 545' ' ' LEU . 0.2 OUTLIER -68.32 -31.66 71.24 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.225 -0.898 . . . . 0.56 111.289 -173.382 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 5.9 t -61.28 -36.79 81.0 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.034 0.445 . . . . 1.58 109.891 179.129 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -76.0 -28.64 57.88 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.77 -0.65 . . . . 0.84 110.961 179.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' B' ' 541' ' ' ASP . 94.6 mt -70.04 -41.42 74.25 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.928 -0.578 . . . . 1.08 111.697 -177.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 59.1 mt -75.44 -24.93 57.1 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.348 0.594 . . . . 0.97 109.791 178.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 55.7 m -93.28 27.45 2.53 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.15 -0.932 . . . . 1.42 111.535 178.337 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -74.38 -17.2 60.84 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 121.476 0.655 . . . . 2.67 109.579 172.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 24.2 mm -94.99 66.69 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 115.239 -0.892 . . . . 5.23 109.135 176.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 20.2 t -140.6 81.72 1.82 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.509 -0.769 . . . . 6.4 109.768 -177.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 5.6 p . . . . . 0 C--O 1.245 0.866 0 CA-C-O 118.34 -0.838 . . . . 7.59 110.091 179.969 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo . . . . . 0 N--CA 1.478 0.578 0 N-CA-C 110.238 -0.716 . . . . 1.89 110.238 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.405 ' HB2' ' HB3' ' A' ' 99' ' ' ASN . 30.1 m -153.57 114.67 4.12 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.932 0.396 . . . . 2.05 110.241 179.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.493 ' HA ' HD12 ' A' ' 18' ' ' ILE . 25.1 m80 -92.17 8.18 39.17 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.96 -0.564 . . . . 0.75 110.071 175.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 56.9 p -157.24 168.47 27.32 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.184 -0.607 . . . . 1.09 111.997 179.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.471 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 175.83 -169.11 41.72 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.108 -0.951 . . . . 0.16 110.814 -179.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -98.07 129.07 44.92 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 117.237 0.519 . . . . 0.16 110.164 177.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.423 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -143.47 145.68 32.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.866 0.365 . . . . 0.11 111.477 -176.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.47 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 83.1 mt -102.89 129.95 53.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 116.332 -0.394 . . . . 0.33 110.091 176.21 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.462 ' O ' HG13 ' A' ' 12' ' ' VAL . 26.0 t80 -141.85 141.02 33.07 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 108.871 -0.788 . . . . 0.36 108.871 178.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 62.48 24.99 14.9 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.826 -0.435 . . . . 0.8 109.826 -176.732 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.5 mtpt 64.61 1.72 1.43 Allowed 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 113.54 0.941 . . . . 2.11 113.54 -177.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.462 HG13 ' O ' ' A' ' 9' ' ' PHE . 0.2 OUTLIER -95.79 125.51 48.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 108.722 -0.844 . . . . 0.22 108.722 169.633 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.446 ' HA ' HG12 ' A' ' 8' ' ' ILE . 59.4 p -75.6 145.13 41.38 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.799 0.333 . . . . 1.07 110.483 -176.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.462 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -160.82 -160.28 10.57 Favored Glycine 0 N--CA 1.438 -1.169 0 C-N-CA 119.742 -1.218 . . . . 0.11 113.926 -175.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 18.3 mm -125.71 131.76 71.6 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 N-CA-C 108.935 -0.765 . . . . 0.13 108.935 -179.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.56 HD11 HD11 ' A' ' 27' ' ' LEU . 0.7 OUTLIER -103.33 136.98 33.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 110.272 -0.27 . . . . 0.13 110.272 -176.357 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.72 130.1 31.54 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.911 0.386 . . . . 0.1 111.486 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.52 HG12 HD23 ' A' ' 27' ' ' LEU . 54.7 mt -86.43 135.25 25.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.854 0 N-CA-C 109.918 -0.401 . . . . 0.27 109.918 177.768 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -109.0 101.06 10.17 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.156 -0.475 . . . . 1.24 110.694 -176.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -114.42 169.73 8.83 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.431 -0.581 . . . . 1.2 109.431 176.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t70 76.01 -1.56 2.93 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.966 0.888 . . . . 0.58 109.96 -177.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 23' ' ' SER . 31.6 m -102.62 -174.87 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 114.472 -1.24 . . . . 0.25 109.928 179.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.6 ' O ' HG23 ' A' ' 22' ' ' VAL . 58.3 m -73.84 164.03 64.08 Favored Pre-proline 0 C--N 1.318 -0.792 0 N-CA-C 105.045 -2.206 . . . . 1.13 105.045 174.05 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_exo -41.18 127.73 2.94 Favored 'Trans proline' 0 C--N 1.352 0.73 0 CA-C-N 121.15 1.446 . . . . 0.16 112.629 -137.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.458 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -51.49 141.27 16.16 Favored 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 113.713 -1.585 . . . . 0.1 112.164 -165.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -125.43 166.76 16.01 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 114.37 -1.286 . . . . 0.32 111.844 -170.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.772 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.3 tm? -115.53 105.03 12.33 Favored 'General case' 0 C--N 1.316 -0.876 0 N-CA-C 107.422 -1.325 . . . . 0.09 107.422 173.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.8 m -99.03 106.9 19.2 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-O 120.933 0.397 . . . . 0.17 111.056 -176.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 82.7 t90 -84.48 132.56 34.53 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 108.907 -0.775 . . . . 0.14 108.907 171.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.495 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . 66.6 mtt180 -124.6 159.09 31.51 Favored 'General case' 0 C--N 1.309 -1.186 0 N-CA-C 108.463 -0.94 . . . . 1.91 108.463 174.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.0 p -71.96 177.57 4.23 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.987 -0.746 . . . . 0.6 108.987 177.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.462 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 3.2 p -60.19 -33.84 72.79 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 119.969 -0.692 . . . . 0.26 110.898 179.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -87.73 -31.63 19.58 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.76 0.79 . . . . 2.12 109.394 171.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.495 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 93.02 11.02 59.22 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 114.51 -1.223 . . . . 0.23 112.29 177.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -60.58 -45.23 94.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.343 -0.614 . . . . 1.73 109.343 173.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.5 tttm -83.52 138.68 33.31 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.652 -0.87 . . . . 1.3 108.652 172.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.454 HG23 ' HG2' ' A' ' 30' ' ' ARG . 9.8 p -143.81 139.88 25.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 CA-C-O 120.849 0.356 . . . . 0.17 110.552 -178.456 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -145.09 115.19 7.45 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.578 -0.283 . . . . 0.41 110.321 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.436 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 50.8 m -108.19 133.74 52.03 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.607 0.595 . . . . 0.15 112.607 -174.609 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.772 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -102.35 130.17 52.66 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.587 0 N-CA-C 108.082 -1.081 . . . . 0.12 108.082 168.989 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.419 ' O ' HG12 ' A' ' 45' ' ' ILE . 74.5 t -93.01 120.68 42.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 O-C-N 121.193 -0.942 . . . . 0.11 109.199 173.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.596 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -68.73 -20.5 64.39 Favored 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 112.916 0.71 . . . . 0.08 112.916 -170.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.5 p -67.49 -18.1 64.93 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.948 -0.76 . . . . 0.87 108.948 176.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.414 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 5.3 p -109.03 14.1 24.22 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.142 -0.936 . . . . 0.15 110.07 -177.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.487 ' HA ' ' HA2' ' A' ' 64' ' ' GLY . 24.7 mm -110.06 138.76 36.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.168 -0.679 . . . . 0.12 109.168 177.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.476 ' HB2' ' HG2' ' A' ' 65' ' ' LYS . 37.2 t70 -101.84 -41.58 6.46 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 116.278 -0.419 . . . . 0.52 110.487 -176.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.431 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 13.1 mtmt -144.51 175.75 9.9 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.983 0.42 . . . . 1.41 111.255 -179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.778 HD11 HD12 ' A' ' 108' ' ' ILE . 0.1 OUTLIER -151.81 140.35 20.65 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.704 -0.85 . . . . 0.73 108.704 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.413 ' HB3' HD11 ' B' ' 546' ' ' LEU . 19.7 mm-40 -139.72 115.89 10.44 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 118.047 0.385 . . . . 1.94 111.734 -173.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.496 ' HB2' ' HD3' ' A' ' 101' ' ' LYS . . . -111.26 144.84 39.78 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.73 0.3 . . . . 0.22 111.661 -178.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.467 ' N ' ' HZ ' ' B' ' 542' ' ' PHE . 61.2 p -64.76 123.71 84.22 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-N 115.827 -0.624 . . . . 0.26 110.898 -177.557 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.439 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 35.1 Cg_exo -54.97 157.16 13.76 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.658 2.239 . . . . 0.38 111.417 175.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.59 -19.78 65.85 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.224 -0.444 . . . . 0.66 111.814 -176.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 3.5 t -93.29 -14.45 26.96 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.166 0.508 . . . . 1.5 110.443 179.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.439 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 17.6 m -65.95 137.39 57.11 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.672 -0.695 . . . . 0.85 111.299 177.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -50.55 -34.86 27.15 Favored 'General case' 0 CA--C 1.506 -0.726 0 CA-C-N 114.748 -1.115 . . . . 1.77 110.419 172.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.494 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 34.4 mmtt -86.3 149.99 24.66 Favored 'General case' 0 N--CA 1.423 -1.776 0 CA-C-N 113.449 -1.705 . . . . 1.63 112.123 -171.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.403 ' O ' ' HG3' ' A' ' 59' ' ' MET . 4.3 mtp -128.82 98.53 5.0 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.831 -1.077 . . . . 1.11 109.238 171.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.51 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.4 OUTLIER -156.49 156.33 33.54 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.651 -0.704 . . . . 0.22 111.045 -171.888 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.4 tt -129.87 119.07 22.71 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.049 -1.093 . . . . 0.1 108.049 175.787 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.519 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 47.9 mtm180 -99.97 141.98 32.06 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 121.208 0.528 . . . . 2.99 110.788 -178.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.956 HD21 HD13 ' A' ' 104' ' ' LEU . 1.2 mm? -120.36 104.62 10.18 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 114.97 -1.014 . . . . 0.13 108.814 177.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.521 HD12 ' N ' ' A' ' 63' ' ' ILE . 1.9 mp -84.37 97.21 4.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 109.285 -0.635 . . . . 0.29 109.285 -174.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.487 ' HA2' ' HA ' ' A' ' 45' ' ' ILE . . . -72.59 148.68 42.32 Favored Glycine 0 N--CA 1.442 -0.942 0 CA-C-N 115.461 -0.791 . . . . 0.54 111.904 179.496 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.476 ' HG2' ' HB2' ' A' ' 46' ' ' ASP . 91.9 mttt -68.57 154.12 42.48 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-O 121.027 0.441 . . . . 0.55 111.793 -176.563 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.65 HG13 ' HA ' ' A' ' 84' ' ' PRO . 0.7 OUTLIER -119.42 156.32 21.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.578 -0.737 . . . . 1.73 109.579 168.115 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.67 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 12.7 m-20 -84.42 79.7 9.47 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.384 -0.969 . . . . 3.23 108.384 174.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -65.47 -2.88 3.65 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.187 -0.46 . . . . 2.39 112.039 -171.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.7 p -67.9 -16.1 63.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.376 0.608 . . . . 2.96 110.336 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.5 ptpt -79.55 42.88 0.53 Allowed 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.584 -0.735 . . . . 2.49 111.188 177.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -44.24 116.68 1.06 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.328 0.585 . . . . 3.4 109.921 -176.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.407 ' HG2' ' N ' ' A' ' 73' ' ' LYS . 77.0 ttt180 -105.89 165.83 10.92 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.072 -0.967 . . . . 3.8 109.853 -166.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.596 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 61.7 mttp -130.63 139.35 50.38 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 109.925 -0.398 . . . . 4.29 109.925 170.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.48 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 2.9 p-10 -86.62 -168.6 2.3 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.017 -0.538 . . . . 4.41 110.377 -177.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -58.9 -31.2 68.41 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.705 0.288 . . . . 5.34 111.618 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.48 ' HG3' ' OD2' ' A' ' 74' ' ' ASP . 16.5 mt-10 -80.18 -14.9 58.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.785 0.326 . . . . 5.38 110.898 -179.013 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 87.94 16.54 59.43 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.738 -0.744 . . . . 4.37 111.695 -177.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.596 ' O ' ' HA ' ' A' ' 73' ' ' LYS . 53.4 m-20 -77.11 138.98 39.84 Favored 'General case' 0 CA--C 1.512 -0.519 0 N-CA-C 109.043 -0.725 . . . . 4.51 109.043 178.383 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -69.79 90.08 0.59 Allowed 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.49 -0.559 . . . . 4.28 109.49 176.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 27.9 m -96.32 123.87 48.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.565 0.698 . . . . 3.1 110.044 -178.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.468 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 1.5 t -90.59 122.47 67.07 Favored Pre-proline 0 C--N 1.313 -1.002 0 N-CA-C 108.452 -0.944 . . . . 2.5 108.452 177.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' ' 81' ' ' VAL . 33.4 Cg_exo -62.57 136.82 60.73 Favored 'Trans proline' 0 CA--C 1.513 -0.574 0 C-N-CA 123.009 2.473 . . . . 1.87 111.642 -176.174 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.407 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -80.86 149.23 66.78 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.203 -0.908 . . . . 2.74 109.607 -177.289 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.65 ' HA ' HG13 ' A' ' 66' ' ' VAL . 23.0 Cg_exo -61.62 154.3 60.98 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.771 2.314 . . . . 0.84 111.99 -177.159 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.4 ' O ' ' N ' ' A' ' 64' ' ' GLY . 40.9 mt-30 -68.65 153.05 44.49 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 108.659 -0.867 . . . . 1.57 108.659 178.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.442 ' HG2' HG13 ' A' ' 63' ' ' ILE . 92.5 mtm-85 -141.58 120.62 12.87 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.779 0.8 . . . . 2.52 111.503 -177.113 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.519 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 77.4 m-70 -95.73 146.83 24.21 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.266 -1.334 . . . . 0.72 107.785 179.455 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.51 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 27.6 ttm -140.29 125.91 19.17 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 118.891 0.769 . . . . 0.27 111.775 175.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.438 ' O ' ' HA ' ' A' ' 59' ' ' MET . 10.1 m-85 -112.82 127.26 56.12 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.39 -0.823 . . . . 0.27 109.842 178.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.6 OUTLIER -81.12 149.51 29.13 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 120.924 0.392 . . . . 1.26 110.284 177.388 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.455 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 25.0 m-85 -131.71 174.16 10.41 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.297 0.57 . . . . 0.32 111.533 -174.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -119.51 -21.18 7.5 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.017 -0.992 . . . . 2.38 109.572 175.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.593 ' HB2' HG23 ' A' ' 96' ' ' VAL . 11.1 m120 -130.55 126.89 37.9 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.046 -0.525 . . . . 1.1 110.525 -173.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.567 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 10.6 mmm180 -64.4 -32.86 74.65 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.627 -0.715 . . . . 3.09 111.874 178.083 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.2 m -62.34 -39.0 91.65 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.89 0.376 . . . . 0.35 110.937 -178.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.593 HG23 ' HB2' ' A' ' 93' ' ' ASN . 13.0 t -67.84 -55.21 17.67 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.347 0 CA-C-N 116.025 -0.534 . . . . 0.23 110.384 -179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.617 ' HA ' HD12 ' A' ' 60' ' ' LEU . 13.2 ptp -59.05 -36.15 74.55 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.268 -0.424 . . . . 0.17 111.05 -176.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -64.35 -45.53 87.37 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.55 -0.296 . . . . 0.34 110.274 176.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.405 ' HB3' ' HB2' ' A' ' 2' ' ' SER . 31.1 m-20 -70.2 -42.91 71.72 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.999 -0.546 . . . . 1.36 111.868 -177.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.599 HG22 HD11 ' A' ' 104' ' ' LEU . 38.8 mm -61.41 -55.93 21.2 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.283 0 N-CA-C 109.024 -0.732 . . . . 0.12 109.024 178.357 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.813 ' HA ' HD12 ' A' ' 104' ' ' LEU . 21.2 ttpp -51.36 -51.23 56.37 Favored 'General case' 0 C--O 1.218 -0.584 0 O-C-N 123.742 0.652 . . . . 0.79 110.05 177.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.596 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 45.8 ttp -46.82 -53.45 11.98 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.061 -0.972 . . . . 0.28 111.365 177.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.72 ' O ' HG13 ' A' ' 107' ' ' ILE . 20.0 m -62.56 -52.23 64.23 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.201 -0.454 . . . . 0.18 110.751 179.381 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.956 HD13 HD21 ' A' ' 62' ' ' LEU . 33.0 mt -47.22 -53.36 13.45 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.646 0.736 . . . . 0.09 110.62 175.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.768 ' HG2' HD13 ' A' ' 48' ' ' LEU . 57.4 mt-30 -55.29 -39.8 70.32 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.258 -1.337 . . . . 1.2 112.125 177.43 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.596 ' HG2' ' O ' ' A' ' 102' ' ' MET . 25.9 mm-40 -69.25 -25.67 64.4 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.556 0.693 . . . . 2.37 110.218 178.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.72 HG13 ' O ' ' A' ' 103' ' ' THR . 18.4 mt -82.18 -46.15 19.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 114.952 -1.022 . . . . 0.15 111.08 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.778 HD12 HD11 ' A' ' 48' ' ' LEU . 11.0 mt -62.68 -40.4 88.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.039 -0.528 . . . . 0.19 111.541 -176.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 3.5 p -61.44 -20.63 63.32 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.373 -0.376 . . . . 1.14 111.802 -177.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 92.5 mtt180 -66.28 -51.99 51.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.587 0.708 . . . . 1.64 109.309 173.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -78.18 -16.58 57.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.081 -0.963 . . . . 0.65 110.374 -178.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 1.8 tpmt? -65.93 -36.16 82.6 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.392 -0.822 . . . . 0.76 109.329 174.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -79.34 -39.35 32.93 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-N 115.538 -0.756 . . . . 2.27 109.821 175.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -90.59 41.55 1.06 Allowed 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.268 -0.878 . . . . 1.2 110.808 -177.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 33.2 t70 . . . . . 0 C--O 1.247 0.962 0 CA-C-N 115.597 -0.729 . . . . 2.72 110.59 -176.709 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.672 0 N-CA-C 112.126 -0.39 . . . . 19.89 112.126 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 10.7 p -87.3 135.3 34.81 Favored Pre-proline 0 C--N 1.324 -0.502 0 N-CA-C 110.204 -0.295 . . . . 18.33 110.204 179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.63 95.43 0.07 OUTLIER 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 122.908 2.406 . . . . 17.39 112.022 177.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -84.94 -172.67 49.37 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.851 -0.69 . . . . 16.36 111.913 -179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 73.1 m-85 -93.39 123.18 61.2 Favored Pre-proline 0 C--N 1.319 -0.733 0 CA-C-O 120.654 0.264 . . . . 16.0 110.343 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.69 65.89 3.87 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 123.241 2.627 . . . . 13.15 112.999 -178.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -125.61 17.68 8.12 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.147 -0.479 . . . . 12.36 110.141 178.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -84.15 -53.02 3.41 Favored Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.775 -0.726 . . . . 9.63 111.851 -179.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.46 ' N ' HD13 ' B' ' 527' ' ' LEU . 0.0 OUTLIER -132.34 -168.11 2.0 Allowed 'General case' 0 N--CA 1.447 -0.579 0 CA-C-O 120.345 0.117 . . . . 8.34 110.982 179.01 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 4.4 tt 53.22 47.16 25.0 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 107.944 -1.132 . . . . 10.41 107.944 -173.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 40.0 t 69.44 -60.05 0.47 Allowed 'General case' 0 C--O 1.235 0.296 0 CA-C-N 114.27 -1.332 . . . . 7.62 110.157 -171.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . 82.88 -59.1 5.01 Favored Glycine 0 N--CA 1.44 -1.049 0 N-CA-C 110.611 -0.995 . . . . 5.19 110.611 175.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 10.2 t70 169.44 -41.2 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 113.644 -1.278 . . . . 5.5 108.526 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . 0.447 ' HA ' ' OG ' ' B' ' 535' ' ' SER . 29.4 mt-10 -80.93 13.09 2.85 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 113.347 -1.751 . . . . 5.68 111.775 -167.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -95.67 -30.95 13.48 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 114.501 -1.227 . . . . 3.22 110.074 178.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -109.92 -33.36 6.74 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.976 -0.556 . . . . 4.27 110.511 178.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . 0.497 ' O ' ' HB2' ' B' ' 539' ' ' ASP . 78.9 p -70.41 -19.88 62.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.632 -0.713 . . . . 1.25 110.373 -178.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . 0.422 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 15.5 p -65.03 -41.08 95.57 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.215 0.531 . . . . 2.08 110.775 177.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 34.8 mm -79.27 -37.91 19.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 115.762 -0.654 . . . . 1.29 110.563 179.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -76.31 -1.53 27.15 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.848 0.833 . . . . 0.76 110.339 177.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.497 ' HB2' ' O ' ' B' ' 535' ' ' SER . 19.2 t70 -85.61 -47.83 9.47 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.418 -1.264 . . . . 1.23 109.588 175.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 49.4 ttm -57.83 -34.63 69.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.846 -1.07 . . . . 2.29 109.478 174.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -57.26 -42.54 81.78 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.254 -1.339 . . . . 1.18 111.233 176.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.467 ' HZ ' ' N ' ' A' ' 51' ' ' THR . 0.1 OUTLIER -67.64 -39.61 84.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.935 -0.575 . . . . 0.56 112.011 -170.989 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 34.0 m -61.4 -23.34 65.74 Favored 'General case' 0 N--CA 1.437 -1.101 0 CA-C-N 116.295 -0.411 . . . . 1.58 111.26 -178.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -83.47 -36.75 23.91 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.263 -0.426 . . . . 0.84 110.319 175.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 84.2 mt -63.23 -40.58 97.86 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.935 -0.575 . . . . 1.08 112.439 -176.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . 0.413 HD11 ' HB3' ' A' ' 49' ' ' GLN . 17.3 mt -77.46 -11.24 59.83 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.478 0.656 . . . . 0.97 110.256 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 52.2 m -112.5 42.02 1.91 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.143 -0.935 . . . . 1.42 110.697 176.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -104.5 4.27 32.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.121 -0.491 . . . . 2.67 110.773 177.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 23.6 mm 58.86 55.78 0.28 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 CA-C-N 115.263 -0.88 . . . . 5.23 110.321 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 17.9 m -95.63 -26.73 15.63 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.903 -0.589 . . . . 6.4 110.929 -178.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 C--O 1.251 1.159 0 CA-C-O 118.401 -0.809 . . . . 7.59 111.291 -179.895 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo . . . . . 0 N--CA 1.482 0.796 0 N-CA-C 111.377 -0.278 . . . . 1.89 111.377 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 3' ' ' HIS . 32.8 p -170.01 -39.59 0.02 OUTLIER 'General case' 0 C--O 1.234 0.248 0 C-N-CA 120.979 -0.288 . . . . 2.05 111.697 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.425 ' HB2' ' O ' ' A' ' 2' ' ' SER . 70.7 m80 70.3 -5.43 1.35 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.302 0.641 . . . . 0.75 112.235 179.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.0 p -150.63 165.31 33.76 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.089 0.774 . . . . 1.09 113.089 -170.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.487 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . -179.76 -161.8 27.65 Favored Glycine 0 N--CA 1.443 -0.862 0 CA-C-N 114.472 -1.24 . . . . 0.16 110.434 -179.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.92 133.53 47.88 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 117.438 0.619 . . . . 0.16 110.407 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.611 ' HA ' ' O ' ' A' ' 90' ' ' SER . . . -147.47 148.1 30.89 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.17 0.433 . . . . 0.11 112.17 -176.333 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.816 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 69.7 mt -107.66 124.19 63.54 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-O 120.818 0.342 . . . . 0.33 110.915 177.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 23.4 t80 -123.78 133.81 53.76 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.739 -0.837 . . . . 0.36 108.739 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 53.95 32.06 14.62 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 122.804 0.441 . . . . 0.8 110.947 -177.097 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.4 mtpt 70.98 -1.82 2.55 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 113.435 0.902 . . . . 2.11 113.435 178.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.4 p -92.56 118.78 38.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 108.792 -0.818 . . . . 0.22 108.792 169.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.412 ' HA ' HG12 ' A' ' 8' ' ' ILE . 79.3 p -72.93 145.93 46.45 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.161 -0.472 . . . . 1.07 110.656 -176.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . 0.435 ' HA2' ' N ' ' A' ' 32' ' ' THR . . . -163.82 -157.44 9.35 Favored Glycine 0 N--CA 1.439 -1.164 0 C-N-CA 120.106 -1.045 . . . . 0.11 113.214 -177.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 22.1 mm -126.17 132.12 70.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 109.404 -0.591 . . . . 0.13 109.404 -178.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.548 HD11 HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -100.74 134.89 39.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.859 -0.423 . . . . 0.13 109.859 -177.453 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -137.4 128.78 28.12 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.502 -0.317 . . . . 0.1 111.443 179.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.426 HD13 ' HB ' ' A' ' 103' ' ' THR . 46.9 mt -85.46 138.67 18.66 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 121.267 0.556 . . . . 0.27 109.973 175.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.403 HD22 ' HA ' ' A' ' 19' ' ' ASN . 0.9 OUTLIER -110.42 103.28 11.9 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 114.917 -1.038 . . . . 1.24 110.947 -175.24 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -116.58 169.05 9.64 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.319 -0.623 . . . . 1.2 109.319 175.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 21.7 t70 78.35 -3.31 2.31 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-O 122.251 1.025 . . . . 0.58 109.664 -176.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.638 HG23 ' O ' ' A' ' 23' ' ' SER . 27.1 m -102.82 -174.55 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-N 113.918 -1.492 . . . . 0.25 109.331 178.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.638 ' O ' HG23 ' A' ' 22' ' ' VAL . 64.6 m -72.94 167.92 29.46 Favored Pre-proline 0 C--N 1.314 -0.964 0 N-CA-C 105.404 -2.073 . . . . 1.13 105.404 175.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.417 ' O ' HG13 ' A' ' 41' ' ' VAL . 93.7 Cg_exo -41.15 129.34 3.11 Favored 'Trans proline' 0 C--N 1.354 0.82 0 CA-C-N 121.166 1.452 . . . . 0.16 112.531 -141.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB3' ' CG2' ' A' ' 107' ' ' ILE . . . -52.83 138.75 28.76 Favored 'General case' 0 CA--C 1.514 -0.44 0 CA-C-N 114.182 -1.372 . . . . 0.1 112.2 -162.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -118.89 167.44 11.72 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.094 -0.957 . . . . 0.32 111.797 -171.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.796 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -116.75 105.59 12.56 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 106.988 -1.486 . . . . 0.09 106.988 170.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.411 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.0 m -102.43 106.28 16.99 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-O 120.885 0.374 . . . . 0.17 110.801 -174.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -86.29 129.42 34.86 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 109.009 -0.737 . . . . 0.14 109.009 173.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.469 ' HG2' HG23 ' A' ' 37' ' ' VAL . 73.4 mtt180 -124.15 157.48 34.57 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 108.365 -0.976 . . . . 1.91 108.365 173.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.7 p -68.08 175.45 3.16 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 109.076 -0.712 . . . . 0.6 109.076 178.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.435 ' N ' ' HA2' ' A' ' 14' ' ' GLY . 7.0 p -57.27 -44.27 83.8 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 118.362 0.528 . . . . 0.26 110.678 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -82.73 -26.38 32.01 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.753 -0.658 . . . . 2.12 109.719 172.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.13 16.49 47.17 Favored Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.184 -0.916 . . . . 0.23 112.885 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -62.16 -54.03 46.85 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.478 -0.564 . . . . 1.73 109.478 174.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 ttpt -80.93 140.3 35.37 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.517 -0.765 . . . . 1.3 109.186 176.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.469 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.9 p -149.32 134.81 11.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.022 0.439 . . . . 0.17 111.078 -178.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.0 t60 -139.83 129.16 24.01 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.484 -0.561 . . . . 0.41 109.484 178.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.411 ' OG1' HG23 ' A' ' 28' ' ' THR . 25.1 m -117.56 129.26 55.67 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 112.262 0.468 . . . . 0.15 112.262 -172.259 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.796 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.7 OUTLIER -97.3 128.99 48.02 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.629 0 N-CA-C 107.797 -1.186 . . . . 0.12 107.797 168.775 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.417 HG13 ' O ' ' A' ' 24' ' ' PRO . 68.0 t -92.72 120.8 42.68 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 N-CA-C 108.208 -1.034 . . . . 0.11 108.208 172.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.536 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -67.04 -20.7 65.89 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 113.19 0.811 . . . . 0.08 113.19 -169.036 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 3.7 p -68.41 -15.53 63.58 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.225 0.536 . . . . 0.87 109.906 175.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.2 p -106.26 9.93 31.91 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 115.531 -0.758 . . . . 0.15 109.874 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.528 HG21 ' CD1' ' A' ' 62' ' ' LEU . 25.7 mm -111.9 143.33 21.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.876 -0.602 . . . . 0.12 109.515 179.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -107.03 -44.69 4.33 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.392 -0.367 . . . . 0.52 110.72 -178.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.49 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 9.6 mtmm -138.92 171.53 14.19 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-N 116.452 -0.34 . . . . 1.41 111.212 -176.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.606 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -150.64 135.4 17.4 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.21 -0.663 . . . . 0.73 109.21 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.537 ' HB2' ' HB2' ' A' ' 61' ' ' ARG . 79.7 mm-40 -131.57 120.11 22.43 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 111.934 0.346 . . . . 1.94 111.934 -170.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -116.18 141.93 47.49 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 121.974 -0.454 . . . . 0.22 111.937 -177.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 81.6 p -68.58 121.96 82.88 Favored Pre-proline 0 N--CA 1.464 0.261 0 CA-C-N 115.848 -0.615 . . . . 0.26 110.712 -178.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.465 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 11.1 Cg_exo -59.57 161.08 18.5 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.395 2.063 . . . . 0.38 111.433 175.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.84 -23.51 66.04 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.003 0.43 . . . . 0.66 110.748 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 42.5 m -76.41 -19.26 58.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.789 -0.641 . . . . 1.5 110.648 176.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.465 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 73.2 m -78.15 134.47 37.65 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.373 -0.831 . . . . 0.85 110.316 177.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -57.96 -26.49 62.36 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-O 121.708 0.765 . . . . 1.77 110.673 175.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.588 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 42.4 mmtm -77.81 151.74 33.81 Favored 'General case' 0 N--CA 1.435 -1.206 0 CA-C-N 114.56 -1.2 . . . . 1.63 111.435 -176.488 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.534 ' O ' ' HG3' ' A' ' 59' ' ' MET . 0.0 OUTLIER -127.31 95.57 4.31 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 107.927 -1.138 . . . . 1.11 107.927 168.628 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.588 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.1 OUTLIER -155.13 151.66 28.54 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-O 121.62 0.724 . . . . 0.22 112.084 -173.537 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.9 tt -127.76 119.32 25.5 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.408 -1.269 . . . . 0.1 107.936 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.567 ' HA ' ' O ' ' A' ' 87' ' ' HIS . 30.3 mtm180 -101.01 144.98 29.29 Favored 'General case' 0 C--N 1.309 -1.155 0 CA-C-O 121.111 0.481 . . . . 2.99 111.119 -177.672 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.915 HD21 HD13 ' A' ' 104' ' ' LEU . 1.1 mm? -122.64 106.18 10.74 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.208 -0.905 . . . . 0.13 109.097 178.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.527 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -85.34 98.77 6.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.742 -0.466 . . . . 0.29 109.742 -173.679 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.508 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -74.03 136.73 22.03 Favored Glycine 0 N--CA 1.446 -0.649 0 CA-C-N 115.752 -0.658 . . . . 0.54 112.443 -178.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.476 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 82.0 mttt -53.63 132.82 41.31 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 112.831 0.678 . . . . 0.55 112.831 -176.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.686 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 0.9 OUTLIER -121.34 140.92 43.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.09 -0.959 . . . . 1.73 110.611 174.038 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.696 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 15.3 t70 -80.75 78.7 7.5 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.946 -1.024 . . . . 3.23 109.222 179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -65.65 -3.49 4.78 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.676 0.621 . . . . 2.39 112.676 -169.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.0 p -75.89 -7.93 55.7 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.26 0.552 . . . . 2.96 110.239 170.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.696 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 19.9 ptmt -80.17 37.45 0.38 Allowed 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.44 -0.8 . . . . 2.49 110.719 176.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.532 ' CD ' ' HB ' ' A' ' 81' ' ' VAL . 29.8 mmtm -45.23 114.54 0.75 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.945 -0.571 . . . . 3.4 110.354 -175.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.615 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 69.0 ttt180 -91.26 158.88 16.33 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 107.909 -1.145 . . . . 3.8 107.909 -176.415 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 97.3 mttt -134.4 140.56 46.38 Favored 'General case' 0 C--N 1.311 -1.077 0 N-CA-C 109.535 -0.543 . . . . 4.29 109.535 174.737 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.46 ' OD2' ' HG3' ' A' ' 76' ' ' GLU . 1.6 p-10 -80.14 -169.46 2.06 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.126 -0.488 . . . . 4.41 110.527 -177.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.5 m120 -58.53 -31.75 68.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.727 0.298 . . . . 5.34 111.662 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.519 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 16.5 mt-10 -83.7 -32.42 25.56 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.744 0.307 . . . . 5.38 110.921 -178.009 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 113.78 18.24 7.04 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.594 -0.813 . . . . 4.37 112.32 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.519 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 32.2 m-80 -76.11 131.81 39.65 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.172 -0.677 . . . . 4.51 109.172 177.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -68.08 96.38 0.62 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.098 0.475 . . . . 4.28 109.932 -179.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.615 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 6.7 m -105.45 99.32 8.24 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.953 0 CA-C-O 121.605 0.716 . . . . 3.1 109.077 177.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.532 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 0.5 OUTLIER -87.53 121.31 71.16 Favored Pre-proline 0 C--N 1.312 -1.033 0 CA-C-N 116.078 -0.51 . . . . 2.5 110.2 -177.723 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.447 ' HG2' ' HE2' ' A' ' 70' ' ' LYS . 52.1 Cg_exo -56.7 144.47 86.3 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 C-N-CA 122.975 2.45 . . . . 1.87 112.135 -178.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.593 ' H ' ' HD3' ' A' ' 83' ' ' LYS . 0.9 OUTLIER -91.81 147.24 34.6 Favored Pre-proline 0 C--N 1.312 -1.03 0 N-CA-C 108.254 -1.017 . . . . 2.74 108.254 178.702 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.686 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 40.1 Cg_exo -52.64 147.08 32.07 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 122.566 2.177 . . . . 0.84 111.841 179.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -76.09 112.55 12.65 Favored 'General case' 0 CA--C 1.504 -0.822 0 CA-C-N 115.615 -0.721 . . . . 1.57 109.204 -172.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 84' ' ' PRO . 76.1 mtt180 -103.28 119.29 38.59 Favored 'General case' 0 C--N 1.299 -1.596 0 CA-C-N 115.458 -0.792 . . . . 2.52 110.468 -170.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.567 ' O ' ' HA ' ' A' ' 61' ' ' ARG . 66.0 m-70 -93.18 148.16 22.26 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 107.497 -1.297 . . . . 0.72 107.497 -177.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 35.2 ttm -140.4 127.11 20.4 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 119.687 -0.805 . . . . 0.27 111.666 179.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.596 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 6.0 m-85 -118.11 130.04 55.9 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.418 -0.81 . . . . 0.27 109.536 178.053 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.816 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -79.71 159.33 26.68 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 109.718 -0.475 . . . . 1.26 109.718 179.546 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.475 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 28.8 m-85 -138.73 175.33 9.65 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 120.752 0.311 . . . . 0.32 110.765 -178.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -124.02 -12.3 7.49 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.851 -0.613 . . . . 2.38 109.823 173.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.536 ' HB2' HG23 ' A' ' 96' ' ' VAL . 46.6 m-80 -138.06 128.3 26.03 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.067 -0.515 . . . . 1.1 110.252 -177.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.55 ' HD2' ' SD ' ' A' ' 97' ' ' MET . 13.9 mmm180 -67.24 -30.23 70.08 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.528 -0.76 . . . . 3.09 111.85 -179.604 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 7.9 m -61.88 -39.8 93.18 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.979 0.418 . . . . 0.35 110.549 -179.063 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.578 ' O ' HG12 ' A' ' 100' ' ' ILE . 8.1 t -65.92 -56.03 16.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 115.899 -0.591 . . . . 0.23 110.4 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.583 ' HA ' HD12 ' A' ' 60' ' ' LEU . 14.8 ptp -57.44 -38.03 73.78 Favored 'General case' 0 C--O 1.224 -0.262 0 CA-C-N 116.235 -0.439 . . . . 0.17 111.067 -176.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -64.53 -43.58 93.54 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.449 -0.5 . . . . 0.34 110.466 177.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -70.65 -39.28 73.72 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.141 -0.482 . . . . 1.36 111.585 -179.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.606 HG22 HD11 ' A' ' 104' ' ' LEU . 34.0 mm -63.89 -56.99 13.6 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 108.895 -0.779 . . . . 0.12 108.895 175.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.797 ' HA ' HD12 ' A' ' 104' ' ' LEU . 31.1 ttpt -49.99 -48.75 52.2 Favored 'General case' 0 C--O 1.22 -0.47 0 O-C-N 123.926 0.766 . . . . 0.79 109.793 176.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.684 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 41.9 ttp -49.09 -56.36 9.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.54 -0.755 . . . . 0.28 111.201 177.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.728 ' O ' HG13 ' A' ' 107' ' ' ILE . 32.3 m -58.5 -53.49 57.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.15 -0.477 . . . . 0.18 110.596 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.915 HD13 HD21 ' A' ' 62' ' ' LEU . 26.1 mt -47.5 -53.61 13.85 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.705 -0.68 . . . . 0.09 110.569 175.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.571 ' CG ' HD13 ' A' ' 48' ' ' LEU . 93.9 mt-30 -53.36 -44.06 68.27 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.524 -1.216 . . . . 1.2 112.182 176.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.684 ' HG3' ' O ' ' A' ' 102' ' ' MET . 40.7 mt-30 -62.95 -35.75 81.16 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.753 0.787 . . . . 2.37 109.086 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.728 HG13 ' O ' ' A' ' 103' ' ' THR . 9.3 mt -74.43 -45.63 45.6 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-N 114.326 -1.307 . . . . 0.15 111.417 -177.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.551 HD12 HD11 ' A' ' 48' ' ' LEU . 8.8 mt -63.8 -40.66 89.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.449 -0.341 . . . . 0.19 111.699 -177.242 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 26.7 t -56.31 -24.76 45.66 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.979 0.418 . . . . 1.14 111.045 -178.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 81.2 mtt180 -65.65 -40.94 93.0 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.214 0.53 . . . . 1.64 110.255 176.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -90.9 -16.78 27.57 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.635 -0.711 . . . . 0.65 109.984 -179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.24 -39.08 82.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.135 -0.939 . . . . 0.76 109.215 175.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -73.5 -38.3 65.41 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.539 -0.755 . . . . 2.27 109.782 174.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -92.55 52.07 1.84 Allowed 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 114.842 -1.072 . . . . 1.2 111.353 -175.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.539 -0.744 . . . . 2.72 109.773 176.979 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.585 0 N-CA-C 111.774 -0.53 . . . . 19.89 111.774 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 10.2 t -152.74 107.39 2.7 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-O 120.726 0.298 . . . . 18.33 110.418 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -62.62 136.85 60.63 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 123.092 2.528 . . . . 17.39 111.787 175.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . -176.18 174.97 47.3 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.616 -0.802 . . . . 16.36 112.343 -179.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . 0.487 ' CE2' ' HB2' ' B' ' 525' ' ' ASN . 37.5 t80 -107.68 106.36 58.28 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 109.882 -0.414 . . . . 16.0 109.882 178.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.1 -44.92 6.48 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 122.883 2.389 . . . . 13.15 113.293 -175.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . 0.487 ' HB2' ' CE2' ' B' ' 523' ' ' TYR . 7.8 t30 61.0 87.23 0.09 Allowed 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.167 0.508 . . . . 12.36 110.847 -178.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 179.31 89.18 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.989 -0.624 . . . . 9.63 111.663 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.95 76.61 6.65 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.289 0.566 . . . . 8.34 110.638 -176.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 49.9 tp -109.79 62.75 0.6 Allowed 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 107.268 -1.382 . . . . 10.41 107.268 167.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 27.4 m 61.63 37.93 15.73 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 114.802 -1.09 . . . . 7.62 108.149 -165.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -103.22 14.27 55.1 Favored Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 114.724 -1.125 . . . . 5.19 113.555 -171.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -91.43 -22.56 20.38 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-O 122.804 1.287 . . . . 5.5 107.613 178.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -82.54 -5.19 58.61 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 112.787 -2.006 . . . . 5.68 109.725 178.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -90.98 -18.72 24.19 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 113.928 -1.487 . . . . 3.22 110.317 -177.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -70.61 -2.4 14.17 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.024 -0.534 . . . . 4.27 110.828 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . . . . . . . . . 13.6 p -66.02 -28.19 68.68 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 109.357 -0.608 . . . . 1.25 109.357 172.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 65.7 m -69.46 -31.81 70.35 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.353 -0.839 . . . . 2.08 110.774 175.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . 0.416 HD13 ' HA ' ' B' ' 537' ' ' ILE . 18.6 mm -82.68 -35.88 12.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.057 0.456 . . . . 1.29 110.438 176.091 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . 0.434 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -73.79 0.23 13.76 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-O 121.686 0.755 . . . . 0.76 110.588 177.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -74.34 -41.99 60.16 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 114.924 -1.035 . . . . 1.23 109.018 171.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 46.5 mtm -67.14 -27.39 67.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.134 -0.939 . . . . 2.29 110.098 175.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . 0.434 ' HB2' ' HA ' ' B' ' 538' ' ' ALA . 0.8 OUTLIER -63.19 -53.71 48.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.605 -0.725 . . . . 1.18 109.607 174.796 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.417 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.2 OUTLIER -63.41 -35.05 79.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 114.81 -1.087 . . . . 0.56 111.702 -173.593 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 34.7 m -60.76 -31.68 71.01 Favored 'General case' 0 N--CA 1.441 -0.88 0 CA-C-N 116.26 -0.427 . . . . 1.58 111.788 -177.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -86.02 -27.33 24.87 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.033 0.444 . . . . 0.84 110.505 178.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' B' ' 548' ' ' GLN . 86.4 mt -72.27 -32.75 66.92 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.591 -0.732 . . . . 1.08 112.158 -177.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 20.3 mt -70.75 -27.6 64.07 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.474 0.654 . . . . 0.97 109.608 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 17.1 t -81.13 -65.74 0.97 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.019 -0.991 . . . . 1.42 110.29 -179.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' B' ' 545' ' ' LEU . 14.0 mm100 49.12 47.87 21.51 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 121.49 0.662 . . . . 2.67 111.034 -176.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 62.4 mt -113.64 -40.38 3.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 114.994 -1.003 . . . . 5.23 109.269 176.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 27.9 m -128.0 67.85 1.34 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.321 -0.854 . . . . 6.4 109.566 177.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 8.5 t . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.683 -0.675 . . . . 7.59 109.745 -179.044 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo . . . . . 0 N--CA 1.479 0.626 0 N-CA-C 110.692 -0.542 . . . . 1.89 110.692 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.6 t 59.69 74.46 0.44 Allowed 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.462 0.648 . . . . 2.05 111.451 177.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.424 ' CD2' HG21 ' A' ' 103' ' ' THR . 39.3 m80 -81.46 -7.71 59.62 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.651 -0.704 . . . . 0.75 110.17 174.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.0 p -143.79 168.23 20.43 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-O 120.967 0.413 . . . . 1.09 111.541 -174.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.476 ' HA3' HG11 ' A' ' 96' ' ' VAL . . . 179.77 -159.01 23.18 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 110.824 -0.911 . . . . 0.16 110.824 -178.381 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -106.5 135.72 47.52 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 117.133 0.467 . . . . 0.16 110.176 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.542 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -151.68 140.78 21.22 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.043 0.386 . . . . 0.11 112.043 -177.139 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.751 ' HB ' ' CB ' ' A' ' 90' ' ' SER . 87.0 mt -99.32 126.76 52.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 109.838 -0.43 . . . . 0.33 109.838 173.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 18.9 t80 -125.95 135.19 51.57 Favored 'General case' 0 C--O 1.215 -0.731 0 N-CA-C 108.433 -0.951 . . . . 0.36 108.433 178.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 57.98 26.04 12.97 Favored 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 122.68 0.392 . . . . 0.8 110.754 -177.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm 69.46 1.04 3.15 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.876 0.695 . . . . 2.11 112.876 -177.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 1.6 p -92.54 120.81 42.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 N-CA-C 108.55 -0.907 . . . . 0.22 108.55 168.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.468 ' HA ' HG12 ' A' ' 8' ' ' ILE . 16.2 p -74.84 143.14 44.05 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.749 -0.66 . . . . 1.07 111.266 -174.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -162.82 -158.59 9.79 Favored Glycine 0 N--CA 1.44 -1.046 0 C-N-CA 120.461 -0.876 . . . . 0.11 113.436 -177.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.412 HG23 ' O ' ' A' ' 5' ' ' GLY . 20.4 mm -127.78 132.6 68.76 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 C-N-CA 123.396 0.679 . . . . 0.13 109.362 -176.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.505 HD11 HD11 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -101.61 135.41 38.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 N-CA-C 109.903 -0.406 . . . . 0.13 109.903 -176.708 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -138.15 130.21 28.62 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.499 0.19 . . . . 0.1 111.433 178.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.439 HD13 ' HB ' ' A' ' 103' ' ' THR . 53.8 mt -85.35 136.47 22.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.365 0.603 . . . . 0.27 109.921 175.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -108.47 99.7 9.06 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 114.935 -1.03 . . . . 1.24 111.038 -173.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.511 ' O ' ' HB3' ' A' ' 21' ' ' ASP . 23.8 mt-10 -112.31 171.14 7.69 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.421 -0.955 . . . . 1.2 108.421 174.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.511 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 33.7 t70 79.68 -6.37 1.8 Allowed 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 122.44 1.114 . . . . 0.58 109.499 -177.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.675 HG23 ' O ' ' A' ' 23' ' ' SER . 23.4 m -103.53 -171.44 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.313 -1.001 0 CA-C-N 113.76 -1.564 . . . . 0.25 109.943 -179.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.675 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.2 p -72.02 168.62 21.24 Favored Pre-proline 0 C--N 1.319 -0.737 0 N-CA-C 105.31 -2.107 . . . . 1.13 105.31 174.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . 0.434 ' O ' HG13 ' A' ' 41' ' ' VAL . 72.8 Cg_exo -41.17 128.4 3.03 Favored 'Trans proline' 0 C--N 1.357 1.022 0 CA-C-N 121.594 1.605 . . . . 0.16 112.511 -146.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.539 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -49.2 139.9 10.41 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 114.195 -1.366 . . . . 0.1 112.482 -164.104 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -121.69 168.96 11.19 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 114.687 -1.142 . . . . 0.32 111.375 -170.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.887 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.1 tm? -117.99 107.02 13.54 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 107.141 -1.429 . . . . 0.09 107.141 170.258 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.572 HG23 ' OG1' ' A' ' 39' ' ' THR . 3.3 m -103.84 106.51 17.04 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-O 120.795 0.331 . . . . 0.17 110.875 -174.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.5 t90 -85.76 129.56 34.79 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 108.853 -0.795 . . . . 0.14 108.853 172.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.562 ' HG2' HG23 ' A' ' 37' ' ' VAL . 97.9 mtt180 -124.97 157.43 36.12 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 108.871 -0.789 . . . . 1.91 108.871 174.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 2.2 p -69.84 176.26 3.78 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.849 -0.426 . . . . 0.6 109.849 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.2 p -61.45 -30.58 70.67 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.237 -0.585 . . . . 0.26 111.258 179.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 16.3 m-20 -94.94 -20.25 19.55 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.494 0.664 . . . . 2.12 109.626 171.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.461 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 84.7 17.15 64.31 Favored Glycine 0 N--CA 1.444 -0.809 0 CA-C-N 114.824 -1.08 . . . . 0.23 112.635 177.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -67.38 -51.07 56.44 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 109.191 -0.67 . . . . 1.73 109.191 173.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.3 tttt -78.84 139.09 38.41 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.892 -0.781 . . . . 1.3 108.892 173.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.562 HG23 ' HG2' ' A' ' 30' ' ' ARG . 14.7 p -149.14 136.23 13.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 120.913 0.387 . . . . 0.17 110.739 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.1 t60 -144.2 127.0 16.25 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.77 -0.456 . . . . 0.41 109.77 177.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.572 ' OG1' HG23 ' A' ' 28' ' ' THR . 31.4 m -117.63 132.93 56.43 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 112.406 0.521 . . . . 0.15 112.406 -172.52 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.887 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -99.88 129.45 50.49 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 107.93 -1.137 . . . . 0.12 107.93 168.422 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.434 HG13 ' O ' ' A' ' 24' ' ' PRO . 93.3 t -93.25 121.59 44.05 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 O-C-N 121.044 -1.035 . . . . 0.11 108.544 172.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.577 HD11 HD22 ' A' ' 104' ' ' LEU . 2.6 mm? -67.37 -21.24 65.62 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.32 0.859 . . . . 0.08 113.32 -169.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.1 p -69.37 -13.74 62.53 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.223 -0.591 . . . . 0.87 109.673 175.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.431 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 3.8 p -110.75 11.79 22.55 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.384 -0.826 . . . . 0.15 109.785 -179.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.526 HG21 ' CD1' ' A' ' 62' ' ' LEU . 26.6 mm -110.75 140.76 28.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 N-CA-C 109.071 -0.714 . . . . 0.12 109.071 177.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.411 ' HB2' ' HG2' ' A' ' 65' ' ' LYS . 38.8 t70 -104.8 -41.73 5.56 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.344 -0.389 . . . . 0.52 110.934 -177.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.495 ' C ' ' HG ' ' A' ' 48' ' ' LEU . 9.7 mtmm -140.82 171.73 13.68 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.768 0.318 . . . . 1.41 111.247 -177.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.601 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.0 OUTLIER -150.45 146.48 26.68 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.518 -0.919 . . . . 0.73 108.518 177.622 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.584 ' HG3' HD11 ' A' ' 63' ' ' ILE . 0.5 OUTLIER -142.68 120.96 12.28 Favored 'General case' 0 C--O 1.22 -0.485 0 C-N-CA 121.211 -0.195 . . . . 1.94 110.943 -174.298 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.477 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -117.2 152.16 35.37 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.9 -0.5 . . . . 0.22 111.467 -179.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.544 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 70.5 p -77.64 119.53 77.78 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 115.884 -0.598 . . . . 0.26 110.786 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.536 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 9.9 Cg_exo -60.7 165.47 11.63 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 122.711 2.274 . . . . 0.38 112.015 175.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -69.77 -21.29 63.44 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 121.146 0.498 . . . . 0.66 110.692 -179.063 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 70.6 m -78.91 -16.94 56.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.758 -0.655 . . . . 1.5 110.961 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.536 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 30.1 m -77.32 142.07 39.59 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.802 0.811 . . . . 0.85 112.512 -177.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -55.4 -30.63 60.76 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 113.921 -1.49 . . . . 1.77 110.93 172.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.495 ' HB3' HG21 ' A' ' 51' ' ' THR . 3.0 mptp? -93.27 156.2 16.96 Favored 'General case' 0 N--CA 1.434 -1.266 0 CA-C-N 114.025 -1.443 . . . . 1.63 111.966 -173.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.544 ' HA ' ' OG1' ' A' ' 51' ' ' THR . 73.6 mmm -132.52 98.66 4.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.464 -0.789 . . . . 1.11 109.206 168.754 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.495 ' HG2' ' SD ' ' A' ' 88' ' ' MET . 0.0 OUTLIER -158.18 159.49 36.18 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.573 -0.74 . . . . 0.22 111.395 -170.286 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.6 ' HB2' ' CE1' ' A' ' 91' ' ' PHE . 1.5 tt -134.81 120.14 19.01 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.819 -0.808 . . . . 0.1 108.819 177.609 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.689 ' NE ' ' HG2' ' A' ' 86' ' ' ARG . 1.9 mtp180 -105.33 146.46 29.35 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.1 0.476 . . . . 2.99 111.787 -176.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.913 HD21 HD13 ' A' ' 104' ' ' LEU . 1.1 mm? -127.4 114.67 17.83 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.088 -0.96 . . . . 0.13 109.648 -177.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.584 HD11 ' HG3' ' A' ' 49' ' ' GLN . 1.8 mp -90.74 102.26 13.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 120.936 0.398 . . . . 0.29 110.826 -172.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.488 ' HA2' HD13 ' A' ' 45' ' ' ILE . . . -70.56 137.0 26.79 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.732 -0.667 . . . . 0.54 111.972 178.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.431 ' HD2' ' HA ' ' A' ' 44' ' ' THR . 90.5 mttt -61.4 129.93 43.62 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.305 0.574 . . . . 0.55 112.39 -175.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.655 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 1.4 t -121.11 144.5 29.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 CA-C-N 115.23 -0.896 . . . . 1.73 110.163 171.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 31.6 m-20 -77.78 88.44 4.01 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 115.708 -0.678 . . . . 3.23 109.416 176.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -76.14 -2.47 31.19 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.275 0.559 . . . . 2.39 110.465 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 5.8 p -92.13 2.2 56.73 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.692 -0.686 . . . . 2.96 109.952 172.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 70' ' ' LYS . 4.3 ptmm? -90.57 20.56 4.52 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.588 -0.733 . . . . 2.49 110.285 -178.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.2 mtmt -40.95 114.9 0.52 Allowed 'General case' 0 CA--C 1.51 -0.584 0 CA-C-O 121.765 0.793 . . . . 3.4 111.031 -158.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 78.3 ttt180 -88.38 163.93 15.77 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.345 -1.298 . . . . 3.8 109.131 -168.164 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 78' ' ' ASN . 93.4 mttt -129.49 143.1 50.69 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 109.287 -0.634 . . . . 4.29 109.287 172.072 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 40.5 p30 -82.25 -167.43 1.57 Allowed 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.301 -0.409 . . . . 4.41 110.766 -179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -69.42 -20.47 63.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.776 0.322 . . . . 5.34 111.56 -177.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.538 ' HB2' ' ND2' ' A' ' 78' ' ' ASN . 17.0 mt-10 -89.12 -28.17 20.25 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.039 0.447 . . . . 5.38 109.966 -178.768 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 109.89 16.99 10.01 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 120.97 -0.633 . . . . 4.37 111.912 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.538 ' ND2' ' HB2' ' A' ' 76' ' ' GLU . 45.0 m-80 -78.46 138.94 38.71 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 109.51 -0.552 . . . . 4.51 109.51 178.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -70.15 102.03 1.99 Allowed 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.29 -0.633 . . . . 4.28 109.29 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.578 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 15.8 m -113.43 98.69 7.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.964 0 CA-C-O 121.791 0.805 . . . . 3.1 109.281 177.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.4 ' HA ' ' HD3' ' A' ' 82' ' ' PRO . 2.0 p -92.1 112.81 56.81 Favored Pre-proline 0 C--N 1.315 -0.903 0 CA-C-O 121.256 0.551 . . . . 2.5 110.154 -177.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.492 ' HG2' ' HD3' ' A' ' 70' ' ' LYS . 87.9 Cg_exo -53.48 141.84 60.85 Favored 'Trans proline' 0 CA--C 1.518 -0.318 0 C-N-CA 123.683 2.922 . . . . 1.87 112.985 -176.07 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.46 ' HD3' ' N ' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -95.37 149.1 35.67 Favored Pre-proline 0 C--N 1.319 -0.737 0 CA-C-N 115.344 -0.844 . . . . 2.74 109.674 -179.979 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.655 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 27.4 Cg_exo -59.3 147.53 90.51 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.639 2.226 . . . . 0.84 111.982 177.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 36.5 mt-30 -87.06 113.46 22.83 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 115.534 -0.757 . . . . 1.57 109.361 -174.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.689 ' HG2' ' NE ' ' A' ' 61' ' ' ARG . 18.2 ttp180 -102.4 122.7 44.8 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-N 115.238 -0.892 . . . . 2.52 110.714 -171.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.464 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 85.7 m-70 -92.8 155.87 17.37 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.12 -1.4 . . . . 0.72 108.082 -175.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.495 ' SD ' ' HG2' ' A' ' 59' ' ' MET . 28.0 ttm -141.02 140.16 34.26 Favored 'General case' 0 CA--C 1.505 -0.781 0 CA-C-N 118.278 0.49 . . . . 0.27 110.586 174.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.542 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 13.4 m-85 -125.38 158.53 34.06 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 108.468 -0.938 . . . . 0.27 108.468 171.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.751 ' CB ' ' HB ' ' A' ' 8' ' ' ILE . 5.2 p -99.12 160.42 14.28 Favored 'General case' 0 C--N 1.312 -1.044 0 N-CA-C 109.136 -0.69 . . . . 1.26 109.136 179.403 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . 0.6 ' CE1' ' HB2' ' A' ' 60' ' ' LEU . 38.5 m-85 -145.87 162.82 36.86 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.156 0.503 . . . . 0.32 111.746 176.056 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 29.8 p-10 -123.08 0.5 9.08 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.486 -0.779 . . . . 2.38 109.836 174.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.443 ' HB2' HG23 ' A' ' 96' ' ' VAL . 48.2 m-80 -146.85 126.82 13.63 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.661 -0.7 . . . . 1.1 109.922 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.633 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 14.8 mmm180 -66.26 -38.59 88.19 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.184 -0.462 . . . . 3.09 111.584 178.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.3 m -62.45 -24.22 67.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.05 0.453 . . . . 0.35 110.505 -175.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.624 ' O ' HG12 ' A' ' 100' ' ' ILE . 11.9 t -76.14 -59.58 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.533 0 N-CA-C 109.537 -0.542 . . . . 0.23 109.537 173.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.633 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.2 ptp -58.23 -41.78 84.86 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 116.602 -0.272 . . . . 0.17 111.161 -176.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.518 ' N ' ' HG3' ' A' ' 97' ' ' MET . 32.4 t70 -60.61 -40.81 93.2 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.097 -0.641 . . . . 0.34 110.39 177.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 14.0 m-20 -74.12 -40.91 62.34 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.177 -0.465 . . . . 1.36 111.744 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.624 HG12 ' O ' ' A' ' 96' ' ' VAL . 34.4 mm -61.08 -56.96 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.333 0 N-CA-C 108.51 -0.922 . . . . 0.12 108.51 175.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.799 ' HA ' HD12 ' A' ' 104' ' ' LEU . 30.0 ttpt -50.96 -50.17 58.62 Favored 'General case' 0 C--O 1.216 -0.674 0 O-C-N 124.033 0.833 . . . . 0.79 109.72 177.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.494 ' O ' ' HG2' ' A' ' 106' ' ' GLN . 37.5 ttp -49.91 -55.31 14.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.757 -0.656 . . . . 0.28 111.273 178.212 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.728 ' O ' HG13 ' A' ' 107' ' ' ILE . 53.6 m -57.44 -54.58 45.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.136 -0.484 . . . . 0.18 110.353 178.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.913 HD13 HD21 ' A' ' 62' ' ' LEU . 26.8 mt -46.97 -56.13 6.94 Favored 'General case' 0 C--O 1.224 -0.244 0 C-N-CA 123.333 0.653 . . . . 0.09 110.714 176.316 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.55 ' HG2' HD13 ' A' ' 48' ' ' LEU . 46.6 mt-30 -49.47 -47.43 48.45 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.693 -1.139 . . . . 1.2 112.032 177.382 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 102' ' ' MET . 15.9 mm100 -65.99 -36.78 84.23 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.786 0.803 . . . . 2.37 109.903 -177.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.728 HG13 ' O ' ' A' ' 103' ' ' THR . 8.3 mt -69.12 -44.38 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.741 0 CA-C-N 114.526 -1.216 . . . . 0.15 110.721 178.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 104' ' ' LEU . 8.0 mt -64.56 -43.51 96.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.188 -0.46 . . . . 0.19 111.315 -179.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 42.7 t -55.05 -28.51 52.81 Favored 'General case' 0 C--N 1.33 -0.254 0 O-C-N 123.213 0.32 . . . . 1.14 111.144 -178.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 106' ' ' GLN . 91.8 mtt180 -60.5 -51.02 71.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.482 0.658 . . . . 1.64 109.671 175.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 53.1 m-85 -80.88 -15.13 57.16 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.339 -0.846 . . . . 0.65 110.468 -179.041 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.02 -37.09 78.45 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.074 -0.713 . . . . 0.76 109.074 175.743 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -72.52 -37.83 68.23 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.382 -0.826 . . . . 2.27 109.868 173.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -92.59 51.94 1.81 Allowed 'General case' 0 N--CA 1.442 -0.872 0 CA-C-N 115.103 -0.953 . . . . 1.2 110.757 -176.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 C--O 1.248 0.979 0 CA-C-O 118.376 -0.821 . . . . 2.72 110.641 -177.302 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 111.843 -0.503 . . . . 19.89 111.843 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 45.8 m -127.12 88.93 53.14 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-O 120.802 0.334 . . . . 18.33 111.06 -178.231 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -79.33 176.25 9.88 Favored 'Trans proline' 0 C--O 1.237 0.461 0 C-N-CA 122.888 2.392 . . . . 17.39 112.22 178.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 68.38 32.11 75.13 Favored Glycine 0 N--CA 1.448 -0.517 0 C-N-CA 121.054 -0.593 . . . . 16.36 111.977 -179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -158.12 121.49 2.12 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 110.043 -0.355 . . . . 16.0 110.043 -177.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -79.89 -171.37 1.23 Allowed 'Trans proline' 0 N--CA 1.463 -0.287 0 C-N-CA 122.716 2.277 . . . . 13.15 112.435 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -72.02 -56.77 5.06 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.903 0.383 . . . . 12.36 110.388 179.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -121.35 -169.93 13.82 Favored Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.92 -0.657 . . . . 9.63 112.151 -179.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.4 ' C ' ' H ' ' B' ' 529' ' ' SER . 1.1 pt? -117.8 14.7 14.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.862 0.363 . . . . 8.34 111.037 -178.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . . . . . . . . . 62.1 mt -77.71 27.75 0.17 Allowed 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 116.059 -0.518 . . . . 10.41 111.874 -175.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . 0.4 ' H ' ' C ' ' B' ' 527' ' ' LEU . 37.6 t -148.5 17.18 1.03 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.333 -0.618 . . . . 7.62 109.333 175.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . . . . . . . . . . . -76.08 -83.11 0.47 Allowed Glycine 0 N--CA 1.447 -0.576 0 CA-C-N 115.68 -0.691 . . . . 5.19 112.397 -176.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -139.2 -17.44 1.03 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.265 0.555 . . . . 5.5 111.341 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -89.01 -7.32 56.18 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 122.047 0.927 . . . . 5.68 110.039 -177.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -74.05 -32.2 63.21 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 114.104 -1.407 . . . . 3.22 109.856 -179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -69.34 -31.35 69.73 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.53 -0.759 . . . . 4.27 110.81 -178.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . 0.404 ' HA ' ' HB3' ' B' ' 538' ' ' ALA . 1.2 p -85.66 -15.43 42.41 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 116.136 -0.484 . . . . 1.25 110.654 176.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . 0.473 ' O ' ' HB3' ' B' ' 539' ' ' ASP . 50.3 m -81.51 -37.46 27.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.941 -0.572 . . . . 2.08 110.014 174.114 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 25.1 mm -72.87 -33.82 44.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-O 121.382 0.61 . . . . 1.29 109.674 172.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . 0.417 ' HA ' ' HB2' ' B' ' 541' ' ' ASP . . . -80.96 13.28 2.78 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.671 0.748 . . . . 0.76 110.422 174.106 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.504 ' HA ' ' NH1' ' A' ' 61' ' ' ARG . 21.6 t70 -94.39 -43.6 8.31 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.26 -0.882 . . . . 1.23 108.769 173.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 4.7 mpp? -64.65 -22.62 67.02 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.578 -0.737 . . . . 2.29 109.713 169.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . 0.455 ' OD2' ' HE3' ' A' ' 57' ' ' LYS . 33.9 t70 -59.73 -46.16 89.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.194 -0.912 . . . . 1.18 110.774 175.386 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.566 ' CE2' ' HG3' ' A' ' 61' ' ' ARG . 0.4 OUTLIER -71.71 -31.13 66.4 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.457 -0.792 . . . . 0.56 112.048 -169.28 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.16 -44.59 97.08 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-O 121.064 0.459 . . . . 1.58 110.729 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -77.13 -24.05 51.67 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.082 -0.508 . . . . 0.84 110.172 176.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -64.39 -45.53 87.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.48 -0.782 . . . . 1.08 111.374 -178.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . 0.552 HD11 ' HB3' ' A' ' 49' ' ' GLN . 96.0 mt -75.39 -35.99 60.97 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.325 0.583 . . . . 0.97 110.256 178.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 51.7 m -60.51 -73.65 0.09 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.804 -1.089 . . . . 1.42 111.146 179.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 49.02 38.08 11.82 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.116 0.484 . . . . 2.67 111.447 -177.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 19.2 pt -106.96 -33.52 2.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.98 -0.555 . . . . 5.23 110.676 -177.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 9.0 t 53.85 54.66 9.48 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 109.77 -0.456 . . . . 6.4 109.77 -178.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 8.1 t . . . . . 0 C--O 1.25 1.096 0 CA-C-N 115.201 -0.909 . . . . 7.59 110.159 -176.298 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.467 ' HB2' ' OD1' ' A' ' 99' ' ' ASN . 15.0 Cg_exo . . . . . 0 N--CA 1.479 0.674 0 N-CA-C 111.011 -0.419 . . . . 1.89 111.011 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.495 ' O ' ' HB3' ' A' ' 99' ' ' ASN . 22.9 t -162.96 95.22 0.86 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-O 121.307 0.575 . . . . 2.05 110.461 177.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.594 ' HB2' HD12 ' A' ' 18' ' ' ILE . 22.4 p-80 -107.72 31.31 5.56 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.829 0.823 . . . . 0.75 109.412 173.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 55.0 p -160.46 148.25 16.25 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.09 -0.959 . . . . 1.09 110.584 171.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.421 ' O ' HG23 ' A' ' 15' ' ' ILE . . . -175.21 -153.81 10.58 Favored Glycine 0 N--CA 1.446 -0.692 0 N-CA-C 111.105 -0.798 . . . . 0.16 111.105 -177.0 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.63 140.28 38.26 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 117.09 0.445 . . . . 0.16 110.001 179.276 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.453 ' HB1' ' HB3' ' A' ' 89' ' ' PHE . . . -152.04 144.36 24.02 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.071 0.462 . . . . 0.11 111.506 -178.505 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.576 ' HB ' ' HB2' ' A' ' 90' ' ' SER . 81.8 mt -109.75 106.59 21.02 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 116.063 -0.517 . . . . 0.33 110.415 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -106.3 138.65 42.1 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 108.762 -0.829 . . . . 0.36 108.762 -178.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 53.66 22.17 2.96 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.912 0.485 . . . . 0.8 111.504 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt 66.97 16.84 10.44 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.906 -0.588 . . . . 2.11 111.724 -178.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.438 HG13 ' CH2' ' A' ' 29' ' ' TRP . 2.3 p -102.52 117.35 47.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 N-CA-C 107.467 -1.309 . . . . 0.22 107.467 163.429 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -74.4 145.32 43.82 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.994 0.425 . . . . 1.07 111.093 -172.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -166.49 -159.38 12.17 Favored Glycine 0 N--CA 1.437 -1.299 0 C-N-CA 120.111 -1.043 . . . . 0.11 113.408 -177.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.421 HG23 ' O ' ' A' ' 5' ' ' GLY . 14.7 mm -124.89 132.09 71.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-N 114.94 -0.63 . . . . 0.13 109.475 -176.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.531 HD11 HD11 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -101.24 134.16 42.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 109.794 -0.447 . . . . 0.13 109.794 -177.696 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -136.29 124.37 22.95 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 116.364 -0.38 . . . . 0.1 110.933 179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.634 HG12 HD23 ' A' ' 27' ' ' LEU . 22.8 mt -84.58 127.17 40.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.385 -0.598 . . . . 0.27 109.385 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.9 t30 -97.7 101.87 13.48 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.864 -0.607 . . . . 1.24 110.533 -173.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -116.41 169.05 9.61 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.136 -0.69 . . . . 1.2 109.136 178.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 25.9 t70 75.92 -1.63 2.93 Favored 'General case' 0 N--CA 1.479 0.994 0 CA-C-O 122.151 0.977 . . . . 0.58 109.971 -177.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 23' ' ' SER . 32.7 m -103.06 -173.89 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 CA-C-N 114.249 -1.341 . . . . 0.25 109.848 179.223 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.635 ' O ' HG23 ' A' ' 22' ' ' VAL . 47.8 m -72.92 167.51 33.28 Favored Pre-proline 0 C--N 1.319 -0.753 0 N-CA-C 105.157 -2.164 . . . . 1.13 105.157 173.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -41.53 126.82 3.15 Favored 'Trans proline' 0 C--N 1.357 0.974 0 CA-C-N 121.413 1.54 . . . . 0.16 112.27 -140.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.442 ' HB3' HG21 ' A' ' 107' ' ' ILE . . . -51.35 140.76 16.6 Favored 'General case' 0 CA--C 1.506 -0.715 0 CA-C-N 114.227 -1.351 . . . . 0.1 112.371 -165.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -124.33 169.13 12.1 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 114.126 -1.397 . . . . 0.32 111.506 -169.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.68 ' HB3' HG22 ' A' ' 40' ' ' VAL . 3.2 tm? -117.32 104.61 11.32 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.471 -1.307 . . . . 0.09 107.471 173.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.428 HG23 ' OG1' ' A' ' 39' ' ' THR . 5.6 m -100.07 106.16 17.88 Favored 'General case' 0 C--N 1.31 -1.123 0 C-N-CA 120.795 -0.362 . . . . 0.17 110.593 -176.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.438 ' CH2' HG13 ' A' ' 12' ' ' VAL . 81.6 t90 -87.07 131.48 34.11 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 108.697 -0.853 . . . . 0.14 108.697 171.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.501 ' HG2' HG23 ' A' ' 37' ' ' VAL . 72.3 mtt180 -126.01 158.58 34.96 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 108.969 -0.752 . . . . 1.91 108.969 174.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 1.9 p -68.42 173.11 5.2 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.789 -0.819 . . . . 0.6 108.789 177.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 7.3 p -56.17 -40.67 74.25 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.572 -0.451 . . . . 0.26 111.398 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -87.83 -22.91 24.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.581 0.705 . . . . 2.12 109.824 173.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.449 ' HA2' ' HB3' ' A' ' 30' ' ' ARG . . . 92.73 16.84 47.1 Favored Glycine 0 N--CA 1.45 -0.426 0 CA-C-N 114.964 -1.016 . . . . 0.23 112.481 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -59.83 -51.8 68.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.293 0.568 . . . . 1.73 109.52 173.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.6 tttt -88.29 144.01 26.68 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.306 -0.861 . . . . 1.3 109.24 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' VAL . . . . . 0.501 HG23 ' HG2' ' A' ' 30' ' ' ARG . 12.6 p -149.3 138.12 15.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 CA-C-O 120.806 0.336 . . . . 0.17 110.941 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -144.09 121.46 11.65 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.645 -0.502 . . . . 0.41 109.645 177.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' A' ' 27' ' ' LEU . 48.1 m -110.79 130.47 55.57 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 111.955 0.354 . . . . 0.15 111.955 -175.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.68 HG22 ' HB3' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -99.56 129.76 49.62 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.77 0 N-CA-C 108.253 -1.018 . . . . 0.12 108.253 169.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.426 ' O ' HG12 ' A' ' 45' ' ' ILE . 64.5 t -92.79 119.03 39.74 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 O-C-N 121.144 -0.973 . . . . 0.11 108.875 173.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.546 HD11 HD22 ' A' ' 104' ' ' LEU . 2.7 mm? -67.25 -16.47 64.3 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 112.47 0.545 . . . . 0.08 112.47 -171.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.532 ' HA ' ' CD2' ' A' ' 111' ' ' TYR . 96.8 p -71.66 -14.36 62.02 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 109.26 -0.644 . . . . 0.87 109.26 176.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 5.3 p -110.1 6.6 22.99 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.321 -0.854 . . . . 0.15 109.871 -179.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.509 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 27.9 mm -107.83 141.33 23.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.652 -0.704 . . . . 0.12 109.268 179.428 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -99.29 -45.42 5.88 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.249 -0.432 . . . . 0.52 110.449 -179.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.522 ' C ' HD22 ' A' ' 48' ' ' LEU . 10.5 mtmm -141.86 174.05 10.94 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.372 0.606 . . . . 1.41 111.83 -175.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.768 HD23 ' HG2' ' A' ' 105' ' ' GLN . 0.0 OUTLIER -137.56 152.59 49.6 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 107.261 -1.385 . . . . 0.73 107.261 174.488 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.57 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.1 OUTLIER -144.05 118.95 9.94 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.298 0.499 . . . . 1.94 110.618 179.038 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.51 ' HB1' ' SD ' ' A' ' 97' ' ' MET . . . -116.67 141.57 48.02 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 122.195 -0.316 . . . . 0.22 111.444 -178.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.425 ' OG1' ' HA ' ' A' ' 58' ' ' MET . 81.3 p -68.74 119.78 71.39 Favored Pre-proline 0 N--CA 1.465 0.291 0 CA-C-N 115.952 -0.567 . . . . 0.26 110.753 -175.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.529 ' HD2' ' OG ' ' A' ' 55' ' ' SER . 7.7 Cg_exo -60.56 163.43 15.45 Favored 'Trans proline' 0 N--CA 1.46 -0.455 0 C-N-CA 122.646 2.231 . . . . 0.38 112.125 178.602 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.01 -21.73 66.41 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.707 -0.679 . . . . 0.66 111.576 -177.211 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 5.9 m -96.51 6.31 48.99 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.009 -0.541 . . . . 1.5 110.673 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.529 ' OG ' ' HD2' ' A' ' 52' ' ' PRO . 42.7 m -89.62 145.52 25.19 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 116.009 -0.541 . . . . 0.85 110.839 174.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 85.8 mt-10 -53.73 -23.39 11.57 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 114.935 -1.03 . . . . 1.77 111.666 175.799 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.627 ' HB3' ' SD ' ' A' ' 59' ' ' MET . 43.2 mmtm -105.2 161.53 14.19 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-N 114.326 -1.306 . . . . 1.63 112.397 -164.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.435 ' HB3' ' HE3' ' A' ' 58' ' ' MET . 83.9 mmm -131.68 97.21 4.15 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 114.847 -1.07 . . . . 1.11 108.528 166.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.627 ' SD ' ' HB3' ' A' ' 57' ' ' LYS . 0.2 OUTLIER -154.14 157.37 38.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.191 0.519 . . . . 0.22 111.676 -172.99 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' A' ' 97' ' ' MET . 1.7 tt -133.63 119.59 19.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.478 -0.934 . . . . 0.1 108.478 177.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.58 ' HG2' ' HB2' ' A' ' 88' ' ' MET . 8.4 mtp180 -103.88 140.88 37.06 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.219 0.533 . . . . 2.99 111.552 -178.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.98 HD21 HD13 ' A' ' 104' ' ' LEU . 1.8 mm? -115.36 111.52 20.97 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.935 -1.029 . . . . 0.13 109.599 176.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ILE . . . . . 0.556 HD12 ' N ' ' A' ' 63' ' ' ILE . 2.1 mp -91.71 98.35 8.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.354 -0.384 . . . . 0.29 110.519 -169.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.479 ' O ' ' HB3' ' A' ' 84' ' ' PRO . . . -68.18 144.23 42.54 Favored Glycine 0 N--CA 1.447 -0.57 0 CA-C-N 115.666 -0.697 . . . . 0.54 112.039 179.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.509 ' HE3' ' O ' ' A' ' 45' ' ' ILE . 81.5 mttt -64.06 126.06 26.47 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 113.213 0.82 . . . . 0.55 113.213 -173.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.623 ' CG2' ' HA ' ' A' ' 84' ' ' PRO . 0.9 OUTLIER -120.78 143.47 32.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 114.565 -1.198 . . . . 1.73 109.916 171.957 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.728 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 22.7 t70 -86.59 83.06 7.7 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 109.175 -0.676 . . . . 3.23 109.175 177.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -62.8 -6.71 3.95 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 112.621 0.6 . . . . 2.39 112.621 -170.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -77.07 -4.08 42.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.069 0.462 . . . . 2.96 110.757 172.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.728 ' HG2' ' O ' ' A' ' 67' ' ' ASP . 20.0 ptmt -82.2 41.93 0.71 Allowed 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.852 -0.613 . . . . 2.49 110.326 175.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.577 ' HE2' ' OE1' ' A' ' 79' ' ' GLU . 23.5 mmtm -44.49 115.11 0.79 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.594 -0.73 . . . . 3.4 110.437 -176.295 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.665 ' HB3' ' O ' ' A' ' 80' ' ' VAL . 77.7 ttt180 -95.68 165.87 12.1 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 107.708 -1.219 . . . . 3.8 107.708 -176.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -128.6 131.95 48.16 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 118.904 0.775 . . . . 4.29 111.215 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -73.21 172.14 11.68 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 114.449 -1.25 . . . . 4.41 110.236 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -51.79 -31.54 27.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.955 0.407 . . . . 5.34 111.405 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 35.0 mt-10 -94.18 15.87 16.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.38 -0.373 . . . . 5.38 111.694 -176.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 73.51 11.77 80.18 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.348 -0.387 . . . . 4.37 113.016 176.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -73.51 131.9 42.28 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.244 -0.651 . . . . 4.51 109.244 176.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.577 ' OE1' ' HE2' ' A' ' 71' ' ' LYS . 26.8 tt0 -68.09 95.28 0.55 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.61 -0.515 . . . . 4.28 109.61 179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.665 ' O ' ' HB3' ' A' ' 72' ' ' ARG . 10.8 m -102.5 99.46 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.975 0 CA-C-O 121.732 0.777 . . . . 3.1 109.277 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.532 ' HB ' ' CD ' ' A' ' 71' ' ' LYS . 1.1 p -82.61 117.76 69.58 Favored Pre-proline 0 C--N 1.308 -1.239 0 CA-C-N 115.704 -0.68 . . . . 2.5 109.776 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.545 ' HG2' ' HE2' ' A' ' 70' ' ' LYS . 52.9 Cg_exo -54.95 138.88 78.96 Favored 'Trans proline' 0 CA--C 1.511 -0.653 0 C-N-CA 123.282 2.655 . . . . 1.87 112.725 -174.445 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 6.9 mmmm -82.04 140.03 46.21 Favored Pre-proline 0 N--CA 1.422 -1.868 0 CA-C-N 115.212 -0.904 . . . . 2.74 110.936 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.623 ' HA ' ' CG2' ' A' ' 66' ' ' VAL . 26.5 Cg_exo -59.35 146.52 94.55 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.391 2.061 . . . . 0.84 110.588 175.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -78.04 113.97 16.48 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.508 0.67 . . . . 1.57 109.951 -173.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.445 ' HG2' HG13 ' A' ' 63' ' ' ILE . 97.2 mtt180 -107.27 121.01 43.69 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 115.379 -0.828 . . . . 2.52 110.738 -171.237 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' HIS . . . . . 0.58 ' HB2' ' HB2' ' A' ' 62' ' ' LEU . 58.2 m-70 -94.55 110.87 22.64 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.598 -0.89 . . . . 0.72 108.598 -176.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.58 ' HB2' ' HG2' ' A' ' 61' ' ' ARG . 20.1 ttm -108.4 122.1 46.3 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 119.736 -0.786 . . . . 0.27 111.654 -175.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.453 ' HB3' ' HB1' ' A' ' 7' ' ' ALA . 5.9 m-85 -112.08 130.75 55.78 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.035 -0.984 . . . . 0.27 109.65 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . 0.576 ' HB2' ' HB ' ' A' ' 8' ' ' ILE . 0.5 OUTLIER -80.99 151.6 28.39 Favored 'General case' 0 C--N 1.316 -0.886 0 O-C-N 122.035 -0.415 . . . . 1.26 110.526 177.122 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -133.52 174.39 10.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.231 -0.441 . . . . 0.32 111.149 -175.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 28.5 p-10 -115.71 -22.16 9.3 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.547 -0.751 . . . . 2.38 111.032 178.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 55.0 m-80 -141.37 142.29 33.78 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.969 0.414 . . . . 1.1 110.528 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.655 ' HA ' ' HG2' ' A' ' 97' ' ' MET . 12.0 mmm180 -67.61 -33.22 74.54 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.581 -0.736 . . . . 3.09 111.326 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 12.6 m -59.9 -38.75 83.18 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.17 -0.468 . . . . 0.35 110.512 -175.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.573 ' O ' HG12 ' A' ' 100' ' ' ILE . 6.6 t -67.71 -56.06 14.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 116.19 -0.459 . . . . 0.23 109.952 177.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' MET . . . . . 0.655 ' HG2' ' HA ' ' A' ' 94' ' ' ARG . 13.4 ptp -60.12 -41.09 91.88 Favored 'General case' 0 C--O 1.223 -0.317 0 CA-C-N 116.422 -0.354 . . . . 0.17 111.2 -177.016 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.463 ' N ' ' HG3' ' A' ' 97' ' ' MET . 24.6 t70 -61.96 -39.04 90.78 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 120.0 -0.68 . . . . 0.34 110.534 178.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.495 ' HB3' ' O ' ' A' ' 2' ' ' SER . 7.7 m-80 -72.96 -43.92 61.74 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.38 -0.373 . . . . 1.36 111.393 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.613 HG22 HD11 ' A' ' 104' ' ' LEU . 33.2 mm -60.49 -56.02 20.51 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.343 0 N-CA-C 108.703 -0.851 . . . . 0.12 108.703 176.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.911 ' HA ' HD12 ' A' ' 104' ' ' LEU . 29.4 ttpt -52.43 -48.35 65.81 Favored 'General case' 0 C--O 1.22 -0.486 0 CA-C-N 115.403 -0.817 . . . . 0.79 109.836 178.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.695 ' O ' ' HG3' ' A' ' 106' ' ' GLN . 32.3 ttp -47.56 -59.47 3.23 Favored 'General case' 0 CA--C 1.51 -0.577 0 O-C-N 123.812 0.695 . . . . 0.28 111.099 176.511 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . 0.78 ' O ' HG13 ' A' ' 107' ' ' ILE . 24.3 m -56.41 -50.43 71.64 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.939 -0.573 . . . . 0.18 110.227 -178.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.98 HD13 HD21 ' A' ' 62' ' ' LEU . 25.8 mt -49.0 -56.15 9.82 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-O 121.342 0.591 . . . . 0.09 110.232 175.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.768 ' HG2' HD23 ' A' ' 48' ' ' LEU . 94.0 mt-30 -52.18 -43.12 64.0 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.778 -1.101 . . . . 1.2 112.177 176.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.695 ' HG3' ' O ' ' A' ' 102' ' ' MET . 22.2 mt-30 -66.07 -38.95 89.59 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 122.035 0.922 . . . . 2.37 109.013 -178.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ILE . . . . . 0.78 HG13 ' O ' ' A' ' 103' ' ' THR . 7.8 mt -72.73 -45.57 56.68 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 114.196 -1.365 . . . . 0.15 111.531 -177.476 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ILE . . . . . 0.591 HG13 ' O ' ' A' ' 104' ' ' LEU . 19.1 mt -58.67 -44.07 89.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 N-CA-C 112.226 0.454 . . . . 0.19 112.226 -176.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' SER . . . . . 0.65 ' HA ' ' CG ' ' A' ' 112' ' ' LYS . 12.6 t -66.49 -15.69 63.56 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.776 -0.37 . . . . 1.14 111.865 -176.938 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 82.8 mtp180 -59.42 -35.5 74.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.619 0.723 . . . . 1.64 109.129 168.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.532 ' CD2' ' HA ' ' A' ' 43' ' ' SER . 33.7 m-85 -97.14 -16.93 20.22 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 114.905 -1.043 . . . . 0.65 110.61 -177.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LYS . . . . . 0.65 ' CG ' ' HA ' ' A' ' 109' ' ' SER . 9.1 mmpt? -68.49 -26.52 65.51 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 109.155 -0.684 . . . . 0.76 109.155 172.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -89.0 0.19 56.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.36 -0.836 . . . . 2.27 110.486 173.794 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -134.97 56.47 1.85 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.844 -0.616 . . . . 1.2 111.083 -178.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.305 -0.855 . . . . 2.72 109.789 178.842 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 519' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.655 0 N-CA-C 111.968 -0.453 . . . . 19.89 111.968 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 520' ' ' SER . . . . . . . . . . . . . 23.2 t -141.37 75.75 22.35 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 120.909 0.385 . . . . 18.33 110.298 -179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 521' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -89.18 38.53 0.42 Allowed 'Trans proline' 0 CA--C 1.531 0.335 0 C-N-CA 123.095 2.53 . . . . 17.39 112.718 -178.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 522' ' ' GLY . . . . . . . . . . . . . . . 67.79 48.45 55.25 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.751 -0.738 . . . . 16.36 111.702 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 523' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -107.67 123.29 38.37 Favored Pre-proline 0 C--N 1.32 -0.699 0 N-CA-C 110.476 -0.194 . . . . 16.0 110.476 -178.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_exo -61.11 150.33 84.88 Favored 'Trans proline' 0 C--N 1.344 0.311 0 C-N-CA 122.73 2.287 . . . . 13.15 111.18 175.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 525' ' ' ASN . . . . . . . . . . . . . 41.6 t30 -55.03 101.38 0.05 OUTLIER 'General case' 0 C--O 1.234 0.279 0 O-C-N 123.367 0.417 . . . . 12.36 111.023 -179.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . -87.88 82.77 1.55 Allowed Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.74 -0.664 . . . . 9.63 111.573 179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 527' ' ' LEU . . . . . 0.501 ' HB2' ' O ' ' B' ' 530' ' ' GLY . 0.5 OUTLIER -78.21 33.72 0.19 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.154 0.502 . . . . 8.34 111.619 -178.003 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 528' ' ' LEU . . . . . 0.437 ' O ' HD23 ' B' ' 528' ' ' LEU . 10.4 tt -65.06 -18.38 65.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.732 0.777 . . . . 10.41 109.414 179.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 529' ' ' SER . . . . . . . . . . . . . 5.4 p -130.45 13.77 5.51 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.871 -1.059 . . . . 7.62 109.495 178.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 530' ' ' GLY . . . . . 0.501 ' O ' ' HB2' ' B' ' 527' ' ' LEU . . . -140.05 49.18 0.81 Allowed Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 114.849 -1.069 . . . . 5.19 110.887 -178.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 531' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -97.46 -4.35 38.27 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 122.605 1.193 . . . . 5.5 108.053 -172.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 532' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -91.33 -9.57 44.48 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 113.608 -1.633 . . . . 5.68 109.549 174.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 533' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -85.21 -26.49 26.71 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.834 -1.53 . . . . 3.22 111.987 -172.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 534' ' ' PHE . . . . . . . . . . . . . 1.8 p90 -65.44 -16.83 64.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.445 0.64 . . . . 4.27 110.405 -177.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 535' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' B' ' 539' ' ' ASP . 96.5 p -73.41 -12.75 60.91 Favored 'General case' 0 N--CA 1.447 -0.607 0 CA-C-N 115.486 -0.779 . . . . 1.25 110.624 -177.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 536' ' ' SER . . . . . . . . . . . . . 26.0 m -75.95 -37.07 59.04 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 121.121 0.486 . . . . 2.08 110.289 175.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 537' ' ' ILE . . . . . . . . . . . . . 41.3 mm -78.43 -37.82 22.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-O 121.249 0.547 . . . . 1.29 109.642 175.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 538' ' ' ALA . . . . . . . . . . . . . . . -76.51 4.26 9.57 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.667 0.746 . . . . 0.76 110.486 175.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 539' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' B' ' 535' ' ' SER . 30.7 t70 -89.4 -46.94 8.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.104 -0.953 . . . . 1.23 109.17 173.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 540' ' ' MET . . . . . . . . . . . . . 42.0 mtm -60.33 -32.96 71.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.772 -1.103 . . . . 2.29 109.895 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 541' ' ' ASP . . . . . 0.446 ' O ' ' HG ' ' B' ' 545' ' ' LEU . 2.2 t70 -55.13 -47.15 75.45 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.394 -0.821 . . . . 1.18 109.852 173.357 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 542' ' ' PHE . . . . . 0.435 ' HA ' HD12 ' B' ' 545' ' ' LEU . 0.1 OUTLIER -68.76 -35.12 76.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.241 -0.89 . . . . 0.56 110.988 -175.834 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 543' ' ' SER . . . . . . . . . . . . . 25.9 t -61.48 -36.65 81.06 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.181 -0.463 . . . . 1.58 110.197 178.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 544' ' ' ALA . . . . . . . . . . . . . . . -84.68 -8.61 58.8 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.064 -0.516 . . . . 0.84 111.077 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 545' ' ' LEU . . . . . 0.573 ' O ' ' HG3' ' B' ' 548' ' ' GLN . 61.8 mt -88.27 -42.36 12.31 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.878 0.37 . . . . 1.08 111.811 178.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 546' ' ' LEU . . . . . . . . . . . . . 25.9 mt -74.38 -26.0 59.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.65 0.738 . . . . 0.97 109.368 176.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 547' ' ' SER . . . . . . . . . . . . . 15.4 t -121.37 70.68 0.94 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 114.678 -1.146 . . . . 1.42 109.739 176.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 548' ' ' GLN . . . . . 0.573 ' HG3' ' O ' ' B' ' 545' ' ' LEU . 49.1 mt-30 -83.66 45.57 1.08 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.076 -0.511 . . . . 2.67 110.866 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 549' ' ' ILE . . . . . . . . . . . . . 22.5 mt 54.24 60.84 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-O 121.667 0.746 . . . . 5.23 109.628 -177.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 550' ' ' SER . . . . . . . . . . . . . 23.3 t -142.8 74.31 1.44 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.438 -0.801 . . . . 6.4 109.826 -175.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.275 -0.869 . . . . 7.59 110.097 179.711 . . . . . . . . 0 0 . 1 stop_ save_